[3-[methyl(thiophen-2-ylmethyl)amino]-4-pyridinyl]methanol

C12H14N2OS — CID 105066711

IUPAC[3-[methyl(thiophen-2-ylmethyl)amino]-4-pyridinyl]methanol
SMILESCN(Cc1cccs1)c1cnccc1CO
InChIInChI=1S/C12H14N2OS/c1-14(8-11-3-2-6-16-11)12-7-13-5-4-10(12)9-15/h2-7,15H,8-9H2,1H3
InChIKeyXLJWIZOVLDWREY-UHFFFAOYSA-N
MW234.32 g/mol
LogP2.27
Rot. Bonds4

About [3-[methyl(thiophen-2-ylmethyl)amino]-4-pyridinyl]methanol

[3-[methyl(thiophen-2-ylmethyl)amino]-4-pyridinyl]methanol (PubChem CID 105066711) has the molecular formula C12H14N2OS and a molecular weight of 234.32 g/mol. Its IUPAC name is [3-[methyl(thiophen-2-ylmethyl)amino]-4-pyridinyl]methanol.

Molecular Properties

Compound Name[3-[methyl(thiophen-2-ylmethyl)amino]-4-pyridinyl]methanol
PubChem CID105066711
Molecular FormulaC12H14N2OS
Molecular Weight234.32 g/mol
Exact Mass234.08
IUPAC Name[3-[methyl(thiophen-2-ylmethyl)amino]-4-pyridinyl]methanol
SMILESCN(Cc1cccs1)c1cnccc1CO
InChIInChI=1S/C12H14N2OS/c1-14(8-11-3-2-6-16-11)12-7-13-5-4-10(12)9-15/h2-7,15H,8-9H2,1H3
InChIKeyXLJWIZOVLDWREY-UHFFFAOYSA-N
XLogP2.27
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.32
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [3-[methyl(thiophen-2-ylmethyl)amino]-4-pyridinyl]methanol 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-methyl-3-(propylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-4-amine
CID 81249546
[3-[methyl(2-methylpropyl)amino]-4-pyridinyl]methanol
CID 105066705
4-(chloromethyl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)pyridin-3-amine
CID 105067372
N-ethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine
CID 105073508
[3-[cyclopropylmethyl(methyl)amino]-4-pyridinyl]methanol
CID 105066737
(1R)-1-[2-[methyl(thiophen-2-ylmethyl)amino]phenyl]ethanol
CID 78939689
N-cyclopropyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine
CID 105073669
2-(aminomethyl)-N-methyl-N-(thiophen-2-ylmethyl)aniline
CID 43527788
4-N-methyl-4-N-(thiophen-2-ylmethyl)-1H-pyrazole-4,5-diamine
CID 82236281
[3-(diethylamino)-4-pyridinyl]methanol
CID 105066644
N-propan-2-yl-4-(propylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine
CID 105073477
5-(ethylaminomethyl)-N,2-dimethyl-N-(thiophen-2-ylmethyl)pyridin-4-amine
CID 81250101

Frequently Asked Questions

What is the IUPAC name of [3-[methyl(thiophen-2-ylmethyl)amino]-4-pyridinyl]methanol?
The IUPAC name of [3-[methyl(thiophen-2-ylmethyl)amino]-4-pyridinyl]methanol (CID 105066711) is [3-[methyl(thiophen-2-ylmethyl)amino]-4-pyridinyl]methanol.
What is the SMILES notation for [3-[methyl(thiophen-2-ylmethyl)amino]-4-pyridinyl]methanol?
The canonical SMILES for [3-[methyl(thiophen-2-ylmethyl)amino]-4-pyridinyl]methanol is CN(Cc1cccs1)c1cnccc1CO.
What is the InChIKey of [3-[methyl(thiophen-2-ylmethyl)amino]-4-pyridinyl]methanol?
The InChIKey is XLJWIZOVLDWREY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2OS/c1-14(8-11-3-2-6-16-11)12-7-13-5-4-10(12)9-15/h2-7,15H,8-9H2,1H3.
What are the key properties of [3-[methyl(thiophen-2-ylmethyl)amino]-4-pyridinyl]methanol?
[3-[methyl(thiophen-2-ylmethyl)amino]-4-pyridinyl]methanol has a molecular weight of 234.32 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[methyl(thiophen-2-ylmethyl)amino]-4-pyridinyl]methanol is sourced from PubChem (CID 105066711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).