N-[1-(2-chlorophenyl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine

C17H20ClN3 — CID 43689544

IUPACN-[1-(2-chlorophenyl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine
SMILESCC(Nc1ccc(N2CCCC2)nc1)c1ccccc1Cl
InChIInChI=1S/C17H20ClN3/c1-13(15-6-2-3-7-16(15)18)20-14-8-9-17(19-12-14)21-10-4-5-11-21/h2-3,6-9,12-13,20H,4-5,10-11H2,1H3
InChIKeyQVHQTWOXMJFKMO-UHFFFAOYSA-N
MW301.82 g/mol
LogP4.51
Rot. Bonds4

About N-[1-(2-chlorophenyl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine

N-[1-(2-chlorophenyl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine (PubChem CID 43689544) has the molecular formula C17H20ClN3 and a molecular weight of 301.82 g/mol. Its IUPAC name is N-[1-(2-chlorophenyl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine.

Molecular Properties

Compound NameN-[1-(2-chlorophenyl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine
PubChem CID43689544
Molecular FormulaC17H20ClN3
Molecular Weight301.82 g/mol
Exact Mass301.13
IUPAC NameN-[1-(2-chlorophenyl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine
SMILESCC(Nc1ccc(N2CCCC2)nc1)c1ccccc1Cl
InChIInChI=1S/C17H20ClN3/c1-13(15-6-2-3-7-16(15)18)20-14-8-9-17(19-12-14)21-10-4-5-11-21/h2-3,6-9,12-13,20H,4-5,10-11H2,1H3
InChIKeyQVHQTWOXMJFKMO-UHFFFAOYSA-N
XLogP4.51
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.82
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[1-(2-chlorophenyl)ethyl]-6-pyrrolidin-1-ylpyridin-3-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

N-[1-(2-chlorophenyl)ethyl]-4-pyrrolidin-1-ylaniline
CID 43226933
6-bromo-N-[1-(2-chlorophenyl)ethyl]pyridin-3-amine
CID 113228015
N-[1-(furan-2-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine
CID 43689581
N-[1-(4-bromophenyl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine
CID 43689538
N-[1-(2-chlorophenyl)ethyl]-6-methoxypyridin-3-amine
CID 43189825
N-[1-(3-methylpyrazin-2-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine
CID 102613252
5-[1-(2-chlorophenyl)ethylamino]pyridine-2-carbonitrile
CID 79840053
N-[1-(1H-pyrazol-5-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine
CID 54881348
N-[1-(5-methylthiophen-2-yl)ethyl]-6-piperidin-1-ylpyridin-3-amine
CID 43690335
N-[(1R)-1-(2-chlorophenyl)ethyl]pyridin-4-amine
CID 141011393
N-pentan-2-yl-6-piperidin-1-ylpyridin-3-amine
CID 43690334
2-chloro-N-[3-methyl-1-oxo-1-[(6-pyrrolidin-1-yl-3-pyridinyl)amino]butan-2-yl]benzamide
CID 46533335

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-chlorophenyl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine?
The IUPAC name of N-[1-(2-chlorophenyl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine (CID 43689544) is N-[1-(2-chlorophenyl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine.
What is the SMILES notation for N-[1-(2-chlorophenyl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine?
The canonical SMILES for N-[1-(2-chlorophenyl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine is CC(Nc1ccc(N2CCCC2)nc1)c1ccccc1Cl.
What is the InChIKey of N-[1-(2-chlorophenyl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine?
The InChIKey is QVHQTWOXMJFKMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20ClN3/c1-13(15-6-2-3-7-16(15)18)20-14-8-9-17(19-12-14)21-10-4-5-11-21/h2-3,6-9,12-13,20H,4-5,10-11H2,1H3.
What are the key properties of N-[1-(2-chlorophenyl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine?
N-[1-(2-chlorophenyl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine has a molecular weight of 301.82 g/mol, XLogP of 4.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-chlorophenyl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine is sourced from PubChem (CID 43689544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).