N-(2,2-dimethylcyclohexyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine

C20H31N — CID 79866587

IUPACN-(2,2-dimethylcyclohexyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine
SMILESCC1(C)CCC(NC2CCCCC2(C)C)c2ccccc21
InChIInChI=1S/C20H31N/c1-19(2)14-12-17(15-9-5-6-10-16(15)19)21-18-11-7-8-13-20(18,3)4/h5-6,9-10,17-18,21H,7-8,11-14H2,1-4H3
InChIKeyFENRBIPQWZICGN-UHFFFAOYSA-N
MW285.47 g/mol
LogP5.36
Rot. Bonds2

About N-(2,2-dimethylcyclohexyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine

N-(2,2-dimethylcyclohexyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine (PubChem CID 79866587) has the molecular formula C20H31N and a molecular weight of 285.47 g/mol. Its IUPAC name is N-(2,2-dimethylcyclohexyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine.

Molecular Properties

Compound NameN-(2,2-dimethylcyclohexyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine
PubChem CID79866587
Molecular FormulaC20H31N
Molecular Weight285.47 g/mol
Exact Mass285.25
IUPAC NameN-(2,2-dimethylcyclohexyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine
SMILESCC1(C)CCC(NC2CCCCC2(C)C)c2ccccc21
InChIInChI=1S/C20H31N/c1-19(2)14-12-17(15-9-5-6-10-16(15)19)21-18-11-7-8-13-20(18,3)4/h5-6,9-10,17-18,21H,7-8,11-14H2,1-4H3
InChIKeyFENRBIPQWZICGN-UHFFFAOYSA-N
XLogP5.36
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500285.47
LogP ≤ 55.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-(2,2-dimethylcyclohexyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,4,4-trimethyl-2,3-dihydro-1H-naphthalen-1-amine
CID 43147302
N-(2,2-dimethylcyclopentyl)-2,3-dihydro-1-benzothiophen-3-amine
CID 81338414
N-(3,5-dimethylcyclohexyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine
CID 64731855
N-(2-methoxycyclopentyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine
CID 62088539
N-(2,2-dimethylcyclopentyl)-2,3-dihydro-1-benzofuran-3-amine
CID 79857768
4-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]pyrrolidin-2-one
CID 106182139
4-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]phenol
CID 43742644
N-(2,2-difluoroethyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine
CID 113303571
N-[(4-chlorophenyl)methyl]-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine
CID 43147440
N-[(2-cyclopropylphenyl)methyl]-2,2-dimethylcyclohexan-1-amine
CID 79984326
(2R)-2-[(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)amino]propan-1-ol
CID 114985663
1-cyclohexyl-2-(1-methylcyclopentyl)benzene
CID 54179575

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylcyclohexyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine?
The IUPAC name of N-(2,2-dimethylcyclohexyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine (CID 79866587) is N-(2,2-dimethylcyclohexyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine.
What is the SMILES notation for N-(2,2-dimethylcyclohexyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine?
The canonical SMILES for N-(2,2-dimethylcyclohexyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine is CC1(C)CCC(NC2CCCCC2(C)C)c2ccccc21.
What is the InChIKey of N-(2,2-dimethylcyclohexyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine?
The InChIKey is FENRBIPQWZICGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N/c1-19(2)14-12-17(15-9-5-6-10-16(15)19)21-18-11-7-8-13-20(18,3)4/h5-6,9-10,17-18,21H,7-8,11-14H2,1-4H3.
What are the key properties of N-(2,2-dimethylcyclohexyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine?
N-(2,2-dimethylcyclohexyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine has a molecular weight of 285.47 g/mol, XLogP of 5.36, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylcyclohexyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-amine is sourced from PubChem (CID 79866587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).