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

C11H11ClN2S — CID 103444122

IUPAC1-(3-chloro-2-pyridinyl)-N-methyl-1-thiophen-3-ylmethanamine
SMILESCNC(c1ccsc1)c1ncccc1Cl
InChIInChI=1S/C11H11ClN2S/c1-13-10(8-4-6-15-7-8)11-9(12)3-2-5-14-11/h2-7,10,13H,1H3
InChIKeyMNHXQQKVPAAAIZ-UHFFFAOYSA-N
MW238.74 g/mol
LogP3.11
Rot. Bonds3

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

1-(3-chloro-2-pyridinyl)-N-methyl-1-thiophen-3-ylmethanamine (PubChem CID 103444122) has the molecular formula C11H11ClN2S and a molecular weight of 238.74 g/mol. Its IUPAC name is 1-(3-chloro-2-pyridinyl)-N-methyl-1-thiophen-3-ylmethanamine.

Molecular Properties

Compound Name1-(3-chloro-2-pyridinyl)-N-methyl-1-thiophen-3-ylmethanamine
PubChem CID103444122
Molecular FormulaC11H11ClN2S
Molecular Weight238.74 g/mol
Exact Mass238.03
IUPAC Name1-(3-chloro-2-pyridinyl)-N-methyl-1-thiophen-3-ylmethanamine
SMILESCNC(c1ccsc1)c1ncccc1Cl
InChIInChI=1S/C11H11ClN2S/c1-13-10(8-4-6-15-7-8)11-9(12)3-2-5-14-11/h2-7,10,13H,1H3
InChIKeyMNHXQQKVPAAAIZ-UHFFFAOYSA-N
XLogP3.11
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.74
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-ethyl-2-pyridinyl)-N-methyl-1-thiophen-3-ylmethanamine
CID 82730091
1-(3-chloro-2-pyridinyl)-N-methyl-1-(4-propan-2-ylphenyl)methanamine
CID 103444275
1-(3-chloro-2-pyridinyl)-N-methyl-1-pyrimidin-5-ylmethanamine
CID 103444180
1-(3-chloro-2-pyridinyl)-1-(4-methoxyphenyl)-N-methylmethanamine
CID 103444068
1-(3-chloro-2-pyridinyl)-N-methyl-1-quinolin-3-ylmethanamine
CID 103444108
1-(3-chloro-2-pyridinyl)-N-methyl-1-(4-propan-2-yloxyphenyl)methanamine
CID 103444188
1-(3-chloro-2-pyridinyl)-N-methyl-1-quinolin-7-ylmethanamine
CID 103444253
1-(3-chloro-2-pyridinyl)-1-(4-fluoro-3-methylphenyl)-N-methylmethanamine
CID 103444187
[(3-fluoro-2-pyridinyl)-thiophen-3-ylmethyl]hydrazine
CID 105257717
1-(3-chloro-2-pyridinyl)-N-methyl-1-naphthalen-1-ylmethanamine
CID 103444331
3-(3-chloro-2-pyridinyl)-N,4-dimethylpentan-2-amine
CID 63198063
1-(3-chloro-2-pyridinyl)-N-methyl-1-[3-(trifluoromethoxy)phenyl]methanamine
CID 103444046

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-2-pyridinyl)-N-methyl-1-thiophen-3-ylmethanamine?
The IUPAC name of 1-(3-chloro-2-pyridinyl)-N-methyl-1-thiophen-3-ylmethanamine (CID 103444122) is 1-(3-chloro-2-pyridinyl)-N-methyl-1-thiophen-3-ylmethanamine.
What is the SMILES notation for 1-(3-chloro-2-pyridinyl)-N-methyl-1-thiophen-3-ylmethanamine?
The canonical SMILES for 1-(3-chloro-2-pyridinyl)-N-methyl-1-thiophen-3-ylmethanamine is CNC(c1ccsc1)c1ncccc1Cl.
What is the InChIKey of 1-(3-chloro-2-pyridinyl)-N-methyl-1-thiophen-3-ylmethanamine?
The InChIKey is MNHXQQKVPAAAIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClN2S/c1-13-10(8-4-6-15-7-8)11-9(12)3-2-5-14-11/h2-7,10,13H,1H3.
What are the key properties of 1-(3-chloro-2-pyridinyl)-N-methyl-1-thiophen-3-ylmethanamine?
1-(3-chloro-2-pyridinyl)-N-methyl-1-thiophen-3-ylmethanamine has a molecular weight of 238.74 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloro-2-pyridinyl)-N-methyl-1-thiophen-3-ylmethanamine is sourced from PubChem (CID 103444122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).