3-propan-2-yl-9-[(7-propan-2-yl-7-azaspiro[3.5]nonan-2-yl)methyl]-3,9-diazaspiro[5.5]undecane

C24H45N3 — CID 155702525

IUPAC3-propan-2-yl-9-[(7-propan-2-yl-7-azaspiro[3.5]nonan-2-yl)methyl]-3,9-diazaspiro[5.5]undecane
SMILESCC(C)N1CCC2(CCN(CC3CC4(CCN(C(C)C)CC4)C3)CC2)CC1
InChIInChI=1S/C24H45N3/c1-20(2)26-13-7-23(8-14-26)5-11-25(12-6-23)19-22-17-24(18-22)9-15-27(16-10-24)21(3)4/h20-22H,5-19H2,1-4H3
InChIKeyWEMDNDQRHDOGJH-UHFFFAOYSA-N
MW375.65 g/mol
LogP4.47
Rot. Bonds4

About 3-propan-2-yl-9-[(7-propan-2-yl-7-azaspiro[3.5]nonan-2-yl)methyl]-3,9-diazaspiro[5.5]undecane

3-propan-2-yl-9-[(7-propan-2-yl-7-azaspiro[3.5]nonan-2-yl)methyl]-3,9-diazaspiro[5.5]undecane (PubChem CID 155702525) has the molecular formula C24H45N3 and a molecular weight of 375.65 g/mol. Its IUPAC name is 3-propan-2-yl-9-[(7-propan-2-yl-7-azaspiro[3.5]nonan-2-yl)methyl]-3,9-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name3-propan-2-yl-9-[(7-propan-2-yl-7-azaspiro[3.5]nonan-2-yl)methyl]-3,9-diazaspiro[5.5]undecane
PubChem CID155702525
Molecular FormulaC24H45N3
Molecular Weight375.65 g/mol
Exact Mass375.36
IUPAC Name3-propan-2-yl-9-[(7-propan-2-yl-7-azaspiro[3.5]nonan-2-yl)methyl]-3,9-diazaspiro[5.5]undecane
SMILESCC(C)N1CCC2(CCN(CC3CC4(CCN(C(C)C)CC4)C3)CC2)CC1
InChIInChI=1S/C24H45N3/c1-20(2)26-13-7-23(8-14-26)5-11-25(12-6-23)19-22-17-24(18-22)9-15-27(16-10-24)21(3)4/h20-22H,5-19H2,1-4H3
InChIKeyWEMDNDQRHDOGJH-UHFFFAOYSA-N
XLogP4.47
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.65
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-propan-2-yl-9-[(7-propan-2-yl-7-azaspiro[3.5]nonan-2-yl)methyl]-3,9-diazaspiro[5.5]undecane with MolForge

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Related Compounds

2-(piperazin-1-ylmethyl)-7-propan-2-yl-7-azaspiro[3.5]nonane
CID 155702528
3-propan-2-yl-9-[(1-propan-2-ylpiperidin-4-yl)methyl]-3,9-diazaspiro[5.5]undecane
CID 155184308
ethane;2-(piperazin-1-ylmethyl)-7-propan-2-yl-7-azaspiro[3.5]nonane
CID 155702527
7-ethyl-2-[(7-propan-2-yl-7-azaspiro[3.5]nonan-2-yl)methyl]-2,7-diazaspiro[3.5]nonane
CID 155702599
2-[(4-tert-butylpiperidin-1-yl)methyl]-7-propan-2-yl-7-azaspiro[3.5]nonane
CID 176760588
2-[(4-propan-2-ylpiperazin-1-yl)methyl]-7-[(1-propylcyclopropyl)methyl]-7-azaspiro[3.5]nonane
CID 174274213
N-methyl-1-(7-propan-2-yl-7-azaspiro[3.5]nonan-2-yl)methanamine
CID 170211191
9-methoxy-3-[(1-propan-2-ylpiperidin-4-yl)methyl]-3-azaspiro[5.5]undecane
CID 155702568
3-(7-propan-2-yl-7-azaspiro[3.5]nonan-2-yl)propan-1-amine
CID 165404477
1-[(3-fluoro-3-methylcyclobutyl)methyl]-4-propan-2-ylpiperazine
CID 126752886
9-ethyl-3-propan-2-yl-3-azaspiro[5.5]undecane
CID 155034031
2-propan-2-yl-7-[(1-propan-2-ylpyrrolidin-3-yl)methyl]-2,7-diazaspiro[3.5]nonane
CID 167417819

Frequently Asked Questions

What is the IUPAC name of 3-propan-2-yl-9-[(7-propan-2-yl-7-azaspiro[3.5]nonan-2-yl)methyl]-3,9-diazaspiro[5.5]undecane?
The IUPAC name of 3-propan-2-yl-9-[(7-propan-2-yl-7-azaspiro[3.5]nonan-2-yl)methyl]-3,9-diazaspiro[5.5]undecane (CID 155702525) is 3-propan-2-yl-9-[(7-propan-2-yl-7-azaspiro[3.5]nonan-2-yl)methyl]-3,9-diazaspiro[5.5]undecane.
What is the SMILES notation for 3-propan-2-yl-9-[(7-propan-2-yl-7-azaspiro[3.5]nonan-2-yl)methyl]-3,9-diazaspiro[5.5]undecane?
The canonical SMILES for 3-propan-2-yl-9-[(7-propan-2-yl-7-azaspiro[3.5]nonan-2-yl)methyl]-3,9-diazaspiro[5.5]undecane is CC(C)N1CCC2(CCN(CC3CC4(CCN(C(C)C)CC4)C3)CC2)CC1.
What is the InChIKey of 3-propan-2-yl-9-[(7-propan-2-yl-7-azaspiro[3.5]nonan-2-yl)methyl]-3,9-diazaspiro[5.5]undecane?
The InChIKey is WEMDNDQRHDOGJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H45N3/c1-20(2)26-13-7-23(8-14-26)5-11-25(12-6-23)19-22-17-24(18-22)9-15-27(16-10-24)21(3)4/h20-22H,5-19H2,1-4H3.
What are the key properties of 3-propan-2-yl-9-[(7-propan-2-yl-7-azaspiro[3.5]nonan-2-yl)methyl]-3,9-diazaspiro[5.5]undecane?
3-propan-2-yl-9-[(7-propan-2-yl-7-azaspiro[3.5]nonan-2-yl)methyl]-3,9-diazaspiro[5.5]undecane has a molecular weight of 375.65 g/mol, XLogP of 4.47, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propan-2-yl-9-[(7-propan-2-yl-7-azaspiro[3.5]nonan-2-yl)methyl]-3,9-diazaspiro[5.5]undecane is sourced from PubChem (CID 155702525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).