3-chloro-N-(2-methyl-2-phenylpropyl)pyridin-2-amine

C15H17ClN2 — CID 54886580

IUPAC3-chloro-N-(2-methyl-2-phenylpropyl)pyridin-2-amine
SMILESCC(C)(CNc1ncccc1Cl)c1ccccc1
InChIInChI=1S/C15H17ClN2/c1-15(2,12-7-4-3-5-8-12)11-18-14-13(16)9-6-10-17-14/h3-10H,11H2,1-2H3,(H,17,18)
InChIKeyJKBBEQRCZQMASB-UHFFFAOYSA-N
MW260.77 g/mol
LogP4.12
Rot. Bonds4

About 3-chloro-N-(2-methyl-2-phenylpropyl)pyridin-2-amine

3-chloro-N-(2-methyl-2-phenylpropyl)pyridin-2-amine (PubChem CID 54886580) has the molecular formula C15H17ClN2 and a molecular weight of 260.77 g/mol. Its IUPAC name is 3-chloro-N-(2-methyl-2-phenylpropyl)pyridin-2-amine.

Molecular Properties

Compound Name3-chloro-N-(2-methyl-2-phenylpropyl)pyridin-2-amine
PubChem CID54886580
Molecular FormulaC15H17ClN2
Molecular Weight260.77 g/mol
Exact Mass260.11
IUPAC Name3-chloro-N-(2-methyl-2-phenylpropyl)pyridin-2-amine
SMILESCC(C)(CNc1ncccc1Cl)c1ccccc1
InChIInChI=1S/C15H17ClN2/c1-15(2,12-7-4-3-5-8-12)11-18-14-13(16)9-6-10-17-14/h3-10H,11H2,1-2H3,(H,17,18)
InChIKeyJKBBEQRCZQMASB-UHFFFAOYSA-N
XLogP4.12
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.77
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-methyl-2-phenylpropyl)-3-(trifluoromethyl)pyridin-2-amine
CID 63541640
N-(2-methyl-2-phenylpropyl)pyridin-2-amine
CID 60970281
5-chloro-N-(2-methyl-2-phenylpropyl)pyrimidin-2-amine
CID 79557000
1-methyl-N-(2-methyl-2-phenylpropyl)imidazo[4,5-c]pyridin-4-amine
CID 103385442
4,6-dichloro-N-(2-methyl-2-phenylpropyl)-1,3,5-triazin-2-amine
CID 114156465
4-chloro-6-[(2-methyl-2-phenylpropyl)amino]pyrimidine-5-carbaldehyde
CID 106193197
3-chloro-N-(3-chloropropyl)pyridin-2-amine
CID 65030223
3-chloro-N-(2-methylprop-2-enyl)pyridin-2-amine
CID 114617517
(2S)-1-N-(3-chloro-2-pyridinyl)propane-1,2-diamine
CID 142991116
3-[(2-methyl-2-phenylpropyl)amino]pyridazine-4-carbonitrile
CID 80515387
N-tert-butyl-2-[(3-chloro-2-pyridinyl)amino]acetamide
CID 115279391
3-chloro-N-[(1-methylcyclopropyl)methyl]pyridin-2-amine
CID 103748441

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(2-methyl-2-phenylpropyl)pyridin-2-amine?
The IUPAC name of 3-chloro-N-(2-methyl-2-phenylpropyl)pyridin-2-amine (CID 54886580) is 3-chloro-N-(2-methyl-2-phenylpropyl)pyridin-2-amine.
What is the SMILES notation for 3-chloro-N-(2-methyl-2-phenylpropyl)pyridin-2-amine?
The canonical SMILES for 3-chloro-N-(2-methyl-2-phenylpropyl)pyridin-2-amine is CC(C)(CNc1ncccc1Cl)c1ccccc1.
What is the InChIKey of 3-chloro-N-(2-methyl-2-phenylpropyl)pyridin-2-amine?
The InChIKey is JKBBEQRCZQMASB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2/c1-15(2,12-7-4-3-5-8-12)11-18-14-13(16)9-6-10-17-14/h3-10H,11H2,1-2H3,(H,17,18).
What are the key properties of 3-chloro-N-(2-methyl-2-phenylpropyl)pyridin-2-amine?
3-chloro-N-(2-methyl-2-phenylpropyl)pyridin-2-amine has a molecular weight of 260.77 g/mol, XLogP of 4.12, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(2-methyl-2-phenylpropyl)pyridin-2-amine is sourced from PubChem (CID 54886580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).