N-[(3-methyl-2-pyridinyl)methyl]-1-thiophen-3-ylmethanamine

C12H14N2S — CID 63305628

IUPACN-[(3-methyl-2-pyridinyl)methyl]-1-thiophen-3-ylmethanamine
SMILESCc1cccnc1CNCc1ccsc1
InChIInChI=1S/C12H14N2S/c1-10-3-2-5-14-12(10)8-13-7-11-4-6-15-9-11/h2-6,9,13H,7-8H2,1H3
InChIKeyWOJVIXSVDHXLBA-UHFFFAOYSA-N
MW218.33 g/mol
LogP2.74
Rot. Bonds4

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

N-[(3-methyl-2-pyridinyl)methyl]-1-thiophen-3-ylmethanamine (PubChem CID 63305628) has the molecular formula C12H14N2S and a molecular weight of 218.33 g/mol. Its IUPAC name is N-[(3-methyl-2-pyridinyl)methyl]-1-thiophen-3-ylmethanamine.

Molecular Properties

Compound NameN-[(3-methyl-2-pyridinyl)methyl]-1-thiophen-3-ylmethanamine
PubChem CID63305628
Molecular FormulaC12H14N2S
Molecular Weight218.33 g/mol
Exact Mass218.09
IUPAC NameN-[(3-methyl-2-pyridinyl)methyl]-1-thiophen-3-ylmethanamine
SMILESCc1cccnc1CNCc1ccsc1
InChIInChI=1S/C12H14N2S/c1-10-3-2-5-14-12(10)8-13-7-11-4-6-15-9-11/h2-6,9,13H,7-8H2,1H3
InChIKeyWOJVIXSVDHXLBA-UHFFFAOYSA-N
XLogP2.74
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.33
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(3-methyl-2-pyridinyl)methyl]-1-thiophen-3-ylmethanamine 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-[(3-methyl-2-pyridinyl)methyl]thiophen-3-amine
CID 112650234
1-(3-methyl-2-pyridinyl)-N-[(3-methylthiophen-2-yl)methyl]methanamine
CID 63305626
N-[(5-methyl-1H-imidazol-4-yl)methyl]-1-thiophen-3-ylmethanamine
CID 63247799
N-[(3-bromothiophen-2-yl)methyl]-1-(3-methyl-2-pyridinyl)methanamine
CID 63305848
N-[(3-methyl-2-pyridinyl)methyl]-1-quinolin-6-ylmethanamine
CID 63306756
1-pyridin-3-yl-N-(thiophen-3-ylmethyl)methanamine;dihydrochloride
CID 163328741
1-(5-chlorothiophen-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]methanamine
CID 63305597
1-thiophen-3-yl-N-[(2,4,5-trimethylphenyl)methyl]methanamine
CID 63001646
N-[(3-methylthiophen-2-yl)methyl]-1-thiophen-3-ylmethanamine
CID 60744110
1-(3-bromo-4,5-dimethoxyphenyl)-N-[(3-methyl-2-pyridinyl)methyl]methanamine
CID 63305915
2-ethoxy-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]propan-1-amine
CID 114942154
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(3-methyl-2-pyridinyl)methyl]methanamine
CID 63305688

Frequently Asked Questions

What is the IUPAC name of N-[(3-methyl-2-pyridinyl)methyl]-1-thiophen-3-ylmethanamine?
The IUPAC name of N-[(3-methyl-2-pyridinyl)methyl]-1-thiophen-3-ylmethanamine (CID 63305628) is N-[(3-methyl-2-pyridinyl)methyl]-1-thiophen-3-ylmethanamine.
What is the SMILES notation for N-[(3-methyl-2-pyridinyl)methyl]-1-thiophen-3-ylmethanamine?
The canonical SMILES for N-[(3-methyl-2-pyridinyl)methyl]-1-thiophen-3-ylmethanamine is Cc1cccnc1CNCc1ccsc1.
What is the InChIKey of N-[(3-methyl-2-pyridinyl)methyl]-1-thiophen-3-ylmethanamine?
The InChIKey is WOJVIXSVDHXLBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2S/c1-10-3-2-5-14-12(10)8-13-7-11-4-6-15-9-11/h2-6,9,13H,7-8H2,1H3.
What are the key properties of N-[(3-methyl-2-pyridinyl)methyl]-1-thiophen-3-ylmethanamine?
N-[(3-methyl-2-pyridinyl)methyl]-1-thiophen-3-ylmethanamine has a molecular weight of 218.33 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methyl-2-pyridinyl)methyl]-1-thiophen-3-ylmethanamine is sourced from PubChem (CID 63305628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).