N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butylaniline;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-ethyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-2-methyl-N-propan-2-ylpropan-2-amine

C91H170N4Si4 — CID 162279505

IUPACN-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butylaniline;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-ethyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-2-methyl-N-propan-2-ylpropan-2-amine
SMILESCC(C)(C)N(C(C)(C)C)[Si](C)(C)C1CCC2CC3CCCCC3CC21.CC(C)(C)N(c1ccccc1)[Si](C)(C)C1CCC2CC3CCCCC3CC21.CC(C)N(C(C)(C)C)[Si](C)(C)C1CCC2CC3CCCCC3CC21.CCN(C(C)(C)C)[Si](C)(C)C1CCC2CC3CCCCC3CC21
InChIInChI=1S/C25H41NSi.C23H45NSi.C22H43NSi.C21H41NSi/c1-25(2,3)26(22-13-7-6-8-14-22)27(4,5)24-16-15-21-17-19-11-9-10-12-20(19)18-23(21)24;1-22(2,3)24(23(4,5)6)25(7,8)21-14-13-19-15-17-11-9-10-12-18(17)16-20(19)21;1-16(2)23(22(3,4)5)24(6,7)21-13-12-19-14-17-10-8-9-11-18(17)15-20(19)21;1-7-22(21(2,3)4)23(5,6)20-13-12-18-14-16-10-8-9-11-17(16)15-19(18)20/h6-8,13-14,19-21,23-24H,9-12,15-18H2,1-5H3;17-21H,9-16H2,1-8H3;16-21H,8-15H2,1-7H3;16-20H,7-15H2,1-6H3
InChIKeyKQHYMKBFHVVNFB-UHFFFAOYSA-N
MW1432.73 g/mol
LogP27.59
Rot. Bonds11

About N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butylaniline;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-ethyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-2-methyl-N-propan-2-ylpropan-2-amine

N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butylaniline;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-ethyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-2-methyl-N-propan-2-ylpropan-2-amine (PubChem CID 162279505) has the molecular formula C91H170N4Si4 and a molecular weight of 1432.73 g/mol. Its IUPAC name is N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butylaniline;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-ethyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-2-methyl-N-propan-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butylaniline;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-ethyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-2-methyl-N-propan-2-ylpropan-2-amine
PubChem CID162279505
Molecular FormulaC91H170N4Si4
Molecular Weight1432.73 g/mol
Exact Mass1431.25
IUPAC NameN-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butylaniline;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-ethyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-2-methyl-N-propan-2-ylpropan-2-amine
SMILESCC(C)(C)N(C(C)(C)C)[Si](C)(C)C1CCC2CC3CCCCC3CC21.CC(C)(C)N(c1ccccc1)[Si](C)(C)C1CCC2CC3CCCCC3CC21.CC(C)N(C(C)(C)C)[Si](C)(C)C1CCC2CC3CCCCC3CC21.CCN(C(C)(C)C)[Si](C)(C)C1CCC2CC3CCCCC3CC21
InChIInChI=1S/C25H41NSi.C23H45NSi.C22H43NSi.C21H41NSi/c1-25(2,3)26(22-13-7-6-8-14-22)27(4,5)24-16-15-21-17-19-11-9-10-12-20(19)18-23(21)24;1-22(2,3)24(23(4,5)6)25(7,8)21-14-13-19-15-17-11-9-10-12-18(17)16-20(19)21;1-16(2)23(22(3,4)5)24(6,7)21-13-12-19-14-17-10-8-9-11-18(17)15-20(19)21;1-7-22(21(2,3)4)23(5,6)20-13-12-18-14-16-10-8-9-11-17(16)15-19(18)20/h6-8,13-14,19-21,23-24H,9-12,15-18H2,1-5H3;17-21H,9-16H2,1-8H3;16-21H,8-15H2,1-7H3;16-20H,7-15H2,1-6H3
InChIKeyKQHYMKBFHVVNFB-UHFFFAOYSA-N
XLogP27.59
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms99
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001432.73
LogP ≤ 527.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butylaniline;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-ethyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-2-methyl-N-propan-2-ylpropan-2-amine with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butylaniline;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-ethyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-2-methyl-N-propan-2-ylpropan-2-amine?
The IUPAC name of N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butylaniline;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-ethyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-2-methyl-N-propan-2-ylpropan-2-amine (CID 162279505) is N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butylaniline;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-ethyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-2-methyl-N-propan-2-ylpropan-2-amine.
What is the SMILES notation for N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butylaniline;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-ethyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-2-methyl-N-propan-2-ylpropan-2-amine?
The canonical SMILES for N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butylaniline;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-ethyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-2-methyl-N-propan-2-ylpropan-2-amine is CC(C)(C)N(C(C)(C)C)[Si](C)(C)C1CCC2CC3CCCCC3CC21.CC(C)(C)N(c1ccccc1)[Si](C)(C)C1CCC2CC3CCCCC3CC21.CC(C)N(C(C)(C)C)[Si](C)(C)C1CCC2CC3CCCCC3CC21.CCN(C(C)(C)C)[Si](C)(C)C1CCC2CC3CCCCC3CC21.
What is the InChIKey of N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butylaniline;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-ethyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-2-methyl-N-propan-2-ylpropan-2-amine?
The InChIKey is KQHYMKBFHVVNFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H41NSi.C23H45NSi.C22H43NSi.C21H41NSi/c1-25(2,3)26(22-13-7-6-8-14-22)27(4,5)24-16-15-21-17-19-11-9-10-12-20(19)18-23(21)24;1-22(2,3)24(23(4,5)6)25(7,8)21-14-13-19-15-17-11-9-10-12-18(17)16-20(19)21;1-16(2)23(22(3,4)5)24(6,7)21-13-12-19-14-17-10-8-9-11-18(17)15-20(19)21;1-7-22(21(2,3)4)23(5,6)20-13-12-18-14-16-10-8-9-11-17(16)15-19(18)20/h6-8,13-14,19-21,23-24H,9-12,15-18H2,1-5H3;17-21H,9-16H2,1-8H3;16-21H,8-15H2,1-7H3;16-20H,7-15H2,1-6H3.
What are the key properties of N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butylaniline;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-ethyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-2-methyl-N-propan-2-ylpropan-2-amine?
N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butylaniline;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-ethyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-2-methyl-N-propan-2-ylpropan-2-amine has a molecular weight of 1432.73 g/mol, XLogP of 27.59, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butylaniline;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-tert-butyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-N-ethyl-2-methylpropan-2-amine;N-[2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl(dimethyl)silyl]-2-methyl-N-propan-2-ylpropan-2-amine is sourced from PubChem (CID 162279505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).