N-(2,3-dihydro-1H-indol-7-ylmethyl)-4,4-dimethylcyclohexan-1-amine

C17H26N2 — CID 80649220

IUPACN-(2,3-dihydro-1H-indol-7-ylmethyl)-4,4-dimethylcyclohexan-1-amine
SMILESCC1(C)CCC(NCc2cccc3c2NCC3)CC1
InChIInChI=1S/C17H26N2/c1-17(2)9-6-15(7-10-17)19-12-14-5-3-4-13-8-11-18-16(13)14/h3-5,15,18-19H,6-12H2,1-2H3
InChIKeyZPWUCXFNPMANOP-UHFFFAOYSA-N
MW258.41 g/mol
LogP3.71
Rot. Bonds3

About N-(2,3-dihydro-1H-indol-7-ylmethyl)-4,4-dimethylcyclohexan-1-amine

N-(2,3-dihydro-1H-indol-7-ylmethyl)-4,4-dimethylcyclohexan-1-amine (PubChem CID 80649220) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-indol-7-ylmethyl)-4,4-dimethylcyclohexan-1-amine.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-indol-7-ylmethyl)-4,4-dimethylcyclohexan-1-amine
PubChem CID80649220
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC NameN-(2,3-dihydro-1H-indol-7-ylmethyl)-4,4-dimethylcyclohexan-1-amine
SMILESCC1(C)CCC(NCc2cccc3c2NCC3)CC1
InChIInChI=1S/C17H26N2/c1-17(2)9-6-15(7-10-17)19-12-14-5-3-4-13-8-11-18-16(13)14/h3-5,15,18-19H,6-12H2,1-2H3
InChIKeyZPWUCXFNPMANOP-UHFFFAOYSA-N
XLogP3.71
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dihydro-1H-indol-7-ylmethyl)cyclohexanamine
CID 80650268
4-N-(2,3-dihydro-1H-indol-7-ylmethyl)cyclohexane-1,4-diamine
CID 80648894
3-(2,3-dihydro-1H-indol-7-ylmethylamino)cyclohexan-1-ol
CID 80648400
4-ethyl-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)cyclohexan-1-amine
CID 80648414
4-(2,3-dihydro-1H-indol-7-ylmethylamino)pyrrolidin-2-one
CID 114155169
4-(1,2,3,4-tetrahydroquinolin-8-ylmethylamino)cyclohexane-1-carboxamide
CID 80649920
N-(2,3-dihydro-1H-indol-7-ylmethyl)-1-phenylmethanamine
CID 80649878
tert-butyl 3-(2,3-dihydro-1H-indol-7-ylmethylamino)pyrrolidine-1-carboxylate
CID 107239400
N-(2,3-dihydro-1H-indol-7-ylmethyl)-3-ethylpentan-3-amine
CID 80650139
[1-[(2,3-dihydro-1H-indol-7-ylmethylamino)methyl]cyclopropyl]methanol
CID 113313189
3-(2,3-dihydro-1H-indol-7-ylmethylamino)-2-methylpropan-1-ol
CID 80650053
2-(2,3-dihydro-1H-indol-7-yl)-N-methylacetamide
CID 115105290

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-indol-7-ylmethyl)-4,4-dimethylcyclohexan-1-amine?
The IUPAC name of N-(2,3-dihydro-1H-indol-7-ylmethyl)-4,4-dimethylcyclohexan-1-amine (CID 80649220) is N-(2,3-dihydro-1H-indol-7-ylmethyl)-4,4-dimethylcyclohexan-1-amine.
What is the SMILES notation for N-(2,3-dihydro-1H-indol-7-ylmethyl)-4,4-dimethylcyclohexan-1-amine?
The canonical SMILES for N-(2,3-dihydro-1H-indol-7-ylmethyl)-4,4-dimethylcyclohexan-1-amine is CC1(C)CCC(NCc2cccc3c2NCC3)CC1.
What is the InChIKey of N-(2,3-dihydro-1H-indol-7-ylmethyl)-4,4-dimethylcyclohexan-1-amine?
The InChIKey is ZPWUCXFNPMANOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-17(2)9-6-15(7-10-17)19-12-14-5-3-4-13-8-11-18-16(13)14/h3-5,15,18-19H,6-12H2,1-2H3.
What are the key properties of N-(2,3-dihydro-1H-indol-7-ylmethyl)-4,4-dimethylcyclohexan-1-amine?
N-(2,3-dihydro-1H-indol-7-ylmethyl)-4,4-dimethylcyclohexan-1-amine has a molecular weight of 258.41 g/mol, XLogP of 3.71, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-indol-7-ylmethyl)-4,4-dimethylcyclohexan-1-amine is sourced from PubChem (CID 80649220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).