N-[1-(azepan-2-yl)propan-2-yl]naphthalen-1-amine

C19H26N2 — CID 79540649

IUPACN-[1-(azepan-2-yl)propan-2-yl]naphthalen-1-amine
SMILESCC(CC1CCCCCN1)Nc1cccc2ccccc12
InChIInChI=1S/C19H26N2/c1-15(14-17-10-3-2-6-13-20-17)21-19-12-7-9-16-8-4-5-11-18(16)19/h4-5,7-9,11-12,15,17,20-21H,2-3,6,10,13-14H2,1H3
InChIKeyKQKZNTSIYJIUOM-UHFFFAOYSA-N
MW282.43 g/mol
LogP4.56
Rot. Bonds4

About N-[1-(azepan-2-yl)propan-2-yl]naphthalen-1-amine

N-[1-(azepan-2-yl)propan-2-yl]naphthalen-1-amine (PubChem CID 79540649) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is N-[1-(azepan-2-yl)propan-2-yl]naphthalen-1-amine.

Molecular Properties

Compound NameN-[1-(azepan-2-yl)propan-2-yl]naphthalen-1-amine
PubChem CID79540649
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC NameN-[1-(azepan-2-yl)propan-2-yl]naphthalen-1-amine
SMILESCC(CC1CCCCCN1)Nc1cccc2ccccc12
InChIInChI=1S/C19H26N2/c1-15(14-17-10-3-2-6-13-20-17)21-19-12-7-9-16-8-4-5-11-18(16)19/h4-5,7-9,11-12,15,17,20-21H,2-3,6,10,13-14H2,1H3
InChIKeyKQKZNTSIYJIUOM-UHFFFAOYSA-N
XLogP4.56
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 54.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[1-(azepan-2-yl)propan-2-yl]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

2-fluoro-N-(1-piperidin-2-ylpropan-2-yl)aniline
CID 79548792
1-[2-[1-(azepan-2-yl)propan-2-ylamino]phenyl]ethanol
CID 79560809
N-(1-piperidin-2-ylpropan-2-yl)quinolin-8-amine
CID 79549224
N-[1-(azepan-2-yl)propan-2-yl]-2-(methoxymethyl)aniline
CID 79559708
N-[1-(azepan-2-yl)propan-2-yl]-2-(difluoromethylsulfanyl)aniline
CID 79540761
N-[1-(azepan-2-yl)propan-2-yl]-5,6,7,8-tetrahydronaphthalen-1-amine
CID 79540760
N-[1-(azepan-2-yl)propan-2-yl]-3-chloro-2-fluoroaniline
CID 79560372
2-bromo-N-(1-pyrrolidin-2-ylpropan-2-yl)aniline
CID 79540004
2-(2-methylpropoxy)-N-(1-piperidin-2-ylpropan-2-yl)aniline
CID 79539102
N-(1-cyclobutylpropan-2-yl)naphthalen-1-amine
CID 113489674
8-methyl-N-(1-piperidin-2-ylpropan-2-yl)quinolin-5-amine
CID 79537260
2-methyl-6-(1-piperidin-2-ylpropan-2-ylamino)benzonitrile
CID 107803271

Frequently Asked Questions

What is the IUPAC name of N-[1-(azepan-2-yl)propan-2-yl]naphthalen-1-amine?
The IUPAC name of N-[1-(azepan-2-yl)propan-2-yl]naphthalen-1-amine (CID 79540649) is N-[1-(azepan-2-yl)propan-2-yl]naphthalen-1-amine.
What is the SMILES notation for N-[1-(azepan-2-yl)propan-2-yl]naphthalen-1-amine?
The canonical SMILES for N-[1-(azepan-2-yl)propan-2-yl]naphthalen-1-amine is CC(CC1CCCCCN1)Nc1cccc2ccccc12.
What is the InChIKey of N-[1-(azepan-2-yl)propan-2-yl]naphthalen-1-amine?
The InChIKey is KQKZNTSIYJIUOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-15(14-17-10-3-2-6-13-20-17)21-19-12-7-9-16-8-4-5-11-18(16)19/h4-5,7-9,11-12,15,17,20-21H,2-3,6,10,13-14H2,1H3.
What are the key properties of N-[1-(azepan-2-yl)propan-2-yl]naphthalen-1-amine?
N-[1-(azepan-2-yl)propan-2-yl]naphthalen-1-amine has a molecular weight of 282.43 g/mol, XLogP of 4.56, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(azepan-2-yl)propan-2-yl]naphthalen-1-amine is sourced from PubChem (CID 79540649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).