N-(2,6-dimethylheptan-4-yl)naphthalen-2-amine

C19H27N — CID 43680210

IUPACN-(2,6-dimethylheptan-4-yl)naphthalen-2-amine
SMILESCC(C)CC(CC(C)C)Nc1ccc2ccccc2c1
InChIInChI=1S/C19H27N/c1-14(2)11-19(12-15(3)4)20-18-10-9-16-7-5-6-8-17(16)13-18/h5-10,13-15,19-20H,11-12H2,1-4H3
InChIKeyITGLUIIHHOMQJH-UHFFFAOYSA-N
MW269.43 g/mol
LogP5.71
Rot. Bonds6

About N-(2,6-dimethylheptan-4-yl)naphthalen-2-amine

N-(2,6-dimethylheptan-4-yl)naphthalen-2-amine (PubChem CID 43680210) has the molecular formula C19H27N and a molecular weight of 269.43 g/mol. Its IUPAC name is N-(2,6-dimethylheptan-4-yl)naphthalen-2-amine.

Molecular Properties

Compound NameN-(2,6-dimethylheptan-4-yl)naphthalen-2-amine
PubChem CID43680210
Molecular FormulaC19H27N
Molecular Weight269.43 g/mol
Exact Mass269.21
IUPAC NameN-(2,6-dimethylheptan-4-yl)naphthalen-2-amine
SMILESCC(C)CC(CC(C)C)Nc1ccc2ccccc2c1
InChIInChI=1S/C19H27N/c1-14(2)11-19(12-15(3)4)20-18-10-9-16-7-5-6-8-17(16)13-18/h5-10,13-15,19-20H,11-12H2,1-4H3
InChIKeyITGLUIIHHOMQJH-UHFFFAOYSA-N
XLogP5.71
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500269.43
LogP ≤ 55.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(3-methylbutyl)-2-(naphthalen-2-ylamino)propanamide
CID 43420253
(2S)-2,4-dimethyl-N-naphthalen-2-ylpentanamide
CID 58642005
2-(naphthalen-2-ylamino)-N-propylpropanamide
CID 43401181
2-amino-4-methyl-N-naphthalen-2-ylpentanamide chloride
CID 5351894
(3S)-3-(naphthalen-2-ylamino)butanoic acid;hydrochloride
CID 71432857
4-methyl-N-(1-naphthalen-2-ylethyl)pentan-2-amine
CID 43371937
N-[1-(4-bromophenyl)ethyl]naphthalen-2-amine
CID 43680266
N-(2,6-dimethylheptan-4-yl)-3,4-dimethoxyaniline
CID 29054156
N-(2,2,3-trimethylbutyl)naphthalen-2-amine
CID 114100780
2-(naphthalen-2-ylamino)-N-pentylpropanamide
CID 43420250
N-[1-(5-ethylthiophen-2-yl)ethyl]naphthalen-2-amine
CID 63425907
N-[4-methyl-1-(naphthalen-2-ylamino)-1-oxopentan-2-yl]benzamide
CID 3024355

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylheptan-4-yl)naphthalen-2-amine?
The IUPAC name of N-(2,6-dimethylheptan-4-yl)naphthalen-2-amine (CID 43680210) is N-(2,6-dimethylheptan-4-yl)naphthalen-2-amine.
What is the SMILES notation for N-(2,6-dimethylheptan-4-yl)naphthalen-2-amine?
The canonical SMILES for N-(2,6-dimethylheptan-4-yl)naphthalen-2-amine is CC(C)CC(CC(C)C)Nc1ccc2ccccc2c1.
What is the InChIKey of N-(2,6-dimethylheptan-4-yl)naphthalen-2-amine?
The InChIKey is ITGLUIIHHOMQJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N/c1-14(2)11-19(12-15(3)4)20-18-10-9-16-7-5-6-8-17(16)13-18/h5-10,13-15,19-20H,11-12H2,1-4H3.
What are the key properties of N-(2,6-dimethylheptan-4-yl)naphthalen-2-amine?
N-(2,6-dimethylheptan-4-yl)naphthalen-2-amine has a molecular weight of 269.43 g/mol, XLogP of 5.71, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylheptan-4-yl)naphthalen-2-amine is sourced from PubChem (CID 43680210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).