3-chloro-N,5-dimethyl-N-[(4-methylphenyl)methyl]pyridin-2-amine

C15H17ClN2 — CID 70610903

IUPAC3-chloro-N,5-dimethyl-N-[(4-methylphenyl)methyl]pyridin-2-amine
SMILESCc1ccc(CN(C)c2ncc(C)cc2Cl)cc1
InChIInChI=1S/C15H17ClN2/c1-11-4-6-13(7-5-11)10-18(3)15-14(16)8-12(2)9-17-15/h4-9H,10H2,1-3H3
InChIKeyODLSAZLZDNQNDW-UHFFFAOYSA-N
MW260.77 g/mol
LogP3.99
Rot. Bonds3

About 3-chloro-N,5-dimethyl-N-[(4-methylphenyl)methyl]pyridin-2-amine

3-chloro-N,5-dimethyl-N-[(4-methylphenyl)methyl]pyridin-2-amine (PubChem CID 70610903) has the molecular formula C15H17ClN2 and a molecular weight of 260.77 g/mol. Its IUPAC name is 3-chloro-N,5-dimethyl-N-[(4-methylphenyl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name3-chloro-N,5-dimethyl-N-[(4-methylphenyl)methyl]pyridin-2-amine
PubChem CID70610903
Molecular FormulaC15H17ClN2
Molecular Weight260.77 g/mol
Exact Mass260.11
IUPAC Name3-chloro-N,5-dimethyl-N-[(4-methylphenyl)methyl]pyridin-2-amine
SMILESCc1ccc(CN(C)c2ncc(C)cc2Cl)cc1
InChIInChI=1S/C15H17ClN2/c1-11-4-6-13(7-5-11)10-18(3)15-14(16)8-12(2)9-17-15/h4-9H,10H2,1-3H3
InChIKeyODLSAZLZDNQNDW-UHFFFAOYSA-N
XLogP3.99
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.77
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-N,5-dimethyl-N-[(4-methylphenyl)methyl]pyridin-2-amine?
The IUPAC name of 3-chloro-N,5-dimethyl-N-[(4-methylphenyl)methyl]pyridin-2-amine (CID 70610903) is 3-chloro-N,5-dimethyl-N-[(4-methylphenyl)methyl]pyridin-2-amine.
What is the SMILES notation for 3-chloro-N,5-dimethyl-N-[(4-methylphenyl)methyl]pyridin-2-amine?
The canonical SMILES for 3-chloro-N,5-dimethyl-N-[(4-methylphenyl)methyl]pyridin-2-amine is Cc1ccc(CN(C)c2ncc(C)cc2Cl)cc1.
What is the InChIKey of 3-chloro-N,5-dimethyl-N-[(4-methylphenyl)methyl]pyridin-2-amine?
The InChIKey is ODLSAZLZDNQNDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2/c1-11-4-6-13(7-5-11)10-18(3)15-14(16)8-12(2)9-17-15/h4-9H,10H2,1-3H3.
What are the key properties of 3-chloro-N,5-dimethyl-N-[(4-methylphenyl)methyl]pyridin-2-amine?
3-chloro-N,5-dimethyl-N-[(4-methylphenyl)methyl]pyridin-2-amine has a molecular weight of 260.77 g/mol, XLogP of 3.99, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N,5-dimethyl-N-[(4-methylphenyl)methyl]pyridin-2-amine is sourced from PubChem (CID 70610903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).