N-butyl-5-chloro-N-methyl-6-(methylaminomethyl)pyridin-2-amine

C12H20ClN3 — CID 62285649

IUPACN-butyl-5-chloro-N-methyl-6-(methylaminomethyl)pyridin-2-amine
SMILESCCCCN(C)c1ccc(Cl)c(CNC)n1
InChIInChI=1S/C12H20ClN3/c1-4-5-8-16(3)12-7-6-10(13)11(15-12)9-14-2/h6-7,14H,4-5,8-9H2,1-3H3
InChIKeyKEYDZBDDYGBMKL-UHFFFAOYSA-N
MW241.77 g/mol
LogP2.69
Rot. Bonds6

About N-butyl-5-chloro-N-methyl-6-(methylaminomethyl)pyridin-2-amine

N-butyl-5-chloro-N-methyl-6-(methylaminomethyl)pyridin-2-amine (PubChem CID 62285649) has the molecular formula C12H20ClN3 and a molecular weight of 241.77 g/mol. Its IUPAC name is N-butyl-5-chloro-N-methyl-6-(methylaminomethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-butyl-5-chloro-N-methyl-6-(methylaminomethyl)pyridin-2-amine
PubChem CID62285649
Molecular FormulaC12H20ClN3
Molecular Weight241.77 g/mol
Exact Mass241.13
IUPAC NameN-butyl-5-chloro-N-methyl-6-(methylaminomethyl)pyridin-2-amine
SMILESCCCCN(C)c1ccc(Cl)c(CNC)n1
InChIInChI=1S/C12H20ClN3/c1-4-5-8-16(3)12-7-6-10(13)11(15-12)9-14-2/h6-7,14H,4-5,8-9H2,1-3H3
InChIKeyKEYDZBDDYGBMKL-UHFFFAOYSA-N
XLogP2.69
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.77
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-butyl-5-chloro-N-methyl-6-(methylaminomethyl)pyridin-2-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'-[5-chloro-6-(methylaminomethyl)-2-pyridinyl]-N,N,N'-trimethylpropane-1,3-diamine
CID 63699861
5-chloro-N-(3-methoxypropyl)-N-methyl-6-(methylaminomethyl)pyridin-2-amine
CID 63008843
N-butyl-5-chloro-6-(methylaminomethyl)-N-phenylpyridin-2-amine
CID 64586601
N'-[5-chloro-6-(methylaminomethyl)-2-pyridinyl]-N'-ethyl-N,N-dimethylpropane-1,3-diamine
CID 102997409
5-chloro-N-methyl-6-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine
CID 62279474
N'-[6-[(tert-butylamino)methyl]-5-chloro-2-pyridinyl]-N,N,N'-trimethylpropane-1,3-diamine
CID 63699864
5-chloro-N-[(4-methoxyphenyl)methyl]-N-methyl-6-(methylaminomethyl)pyridin-2-amine
CID 62294612
N,N-dibutyl-5-chloro-6-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 63489625
N-butyl-5-chloro-N-ethyl-6-(propylaminomethyl)pyridin-2-amine
CID 55054566
1-(3-chloro-6-octoxy-2-pyridinyl)-N-methylmethanamine
CID 55194459
5-chloro-N-methyl-N-(2-methylpropyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62279898
N-butyl-3-chloro-N-methyl-5-(methylaminomethyl)pyridin-2-amine
CID 62285991

Frequently Asked Questions

What is the IUPAC name of N-butyl-5-chloro-N-methyl-6-(methylaminomethyl)pyridin-2-amine?
The IUPAC name of N-butyl-5-chloro-N-methyl-6-(methylaminomethyl)pyridin-2-amine (CID 62285649) is N-butyl-5-chloro-N-methyl-6-(methylaminomethyl)pyridin-2-amine.
What is the SMILES notation for N-butyl-5-chloro-N-methyl-6-(methylaminomethyl)pyridin-2-amine?
The canonical SMILES for N-butyl-5-chloro-N-methyl-6-(methylaminomethyl)pyridin-2-amine is CCCCN(C)c1ccc(Cl)c(CNC)n1.
What is the InChIKey of N-butyl-5-chloro-N-methyl-6-(methylaminomethyl)pyridin-2-amine?
The InChIKey is KEYDZBDDYGBMKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20ClN3/c1-4-5-8-16(3)12-7-6-10(13)11(15-12)9-14-2/h6-7,14H,4-5,8-9H2,1-3H3.
What are the key properties of N-butyl-5-chloro-N-methyl-6-(methylaminomethyl)pyridin-2-amine?
N-butyl-5-chloro-N-methyl-6-(methylaminomethyl)pyridin-2-amine has a molecular weight of 241.77 g/mol, XLogP of 2.69, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-5-chloro-N-methyl-6-(methylaminomethyl)pyridin-2-amine is sourced from PubChem (CID 62285649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).