1-(3-chloro-2-pyridinyl)-N-methyl-1-naphthalen-1-ylmethanamine

C17H15ClN2 — CID 103444331

IUPAC1-(3-chloro-2-pyridinyl)-N-methyl-1-naphthalen-1-ylmethanamine
SMILESCNC(c1ncccc1Cl)c1cccc2ccccc12
InChIInChI=1S/C17H15ClN2/c1-19-16(17-15(18)10-5-11-20-17)14-9-4-7-12-6-2-3-8-13(12)14/h2-11,16,19H,1H3
InChIKeyNVLRVLQQTZHLOD-UHFFFAOYSA-N
MW282.77 g/mol
LogP4.20
Rot. Bonds3

About 1-(3-chloro-2-pyridinyl)-N-methyl-1-naphthalen-1-ylmethanamine

1-(3-chloro-2-pyridinyl)-N-methyl-1-naphthalen-1-ylmethanamine (PubChem CID 103444331) has the molecular formula C17H15ClN2 and a molecular weight of 282.77 g/mol. Its IUPAC name is 1-(3-chloro-2-pyridinyl)-N-methyl-1-naphthalen-1-ylmethanamine.

Molecular Properties

Compound Name1-(3-chloro-2-pyridinyl)-N-methyl-1-naphthalen-1-ylmethanamine
PubChem CID103444331
Molecular FormulaC17H15ClN2
Molecular Weight282.77 g/mol
Exact Mass282.09
IUPAC Name1-(3-chloro-2-pyridinyl)-N-methyl-1-naphthalen-1-ylmethanamine
SMILESCNC(c1ncccc1Cl)c1cccc2ccccc12
InChIInChI=1S/C17H15ClN2/c1-19-16(17-15(18)10-5-11-20-17)14-9-4-7-12-6-2-3-8-13(12)14/h2-11,16,19H,1H3
InChIKeyNVLRVLQQTZHLOD-UHFFFAOYSA-N
XLogP4.20
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(3-chloro-2-pyridinyl)-N-methyl-1-naphthalen-1-ylmethanamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-2-pyridinyl)-N-methyl-1-naphthalen-1-ylmethanamine?
The IUPAC name of 1-(3-chloro-2-pyridinyl)-N-methyl-1-naphthalen-1-ylmethanamine (CID 103444331) is 1-(3-chloro-2-pyridinyl)-N-methyl-1-naphthalen-1-ylmethanamine.
What is the SMILES notation for 1-(3-chloro-2-pyridinyl)-N-methyl-1-naphthalen-1-ylmethanamine?
The canonical SMILES for 1-(3-chloro-2-pyridinyl)-N-methyl-1-naphthalen-1-ylmethanamine is CNC(c1ncccc1Cl)c1cccc2ccccc12.
What is the InChIKey of 1-(3-chloro-2-pyridinyl)-N-methyl-1-naphthalen-1-ylmethanamine?
The InChIKey is NVLRVLQQTZHLOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN2/c1-19-16(17-15(18)10-5-11-20-17)14-9-4-7-12-6-2-3-8-13(12)14/h2-11,16,19H,1H3.
What are the key properties of 1-(3-chloro-2-pyridinyl)-N-methyl-1-naphthalen-1-ylmethanamine?
1-(3-chloro-2-pyridinyl)-N-methyl-1-naphthalen-1-ylmethanamine has a molecular weight of 282.77 g/mol, XLogP of 4.20, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloro-2-pyridinyl)-N-methyl-1-naphthalen-1-ylmethanamine is sourced from PubChem (CID 103444331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).