N-[(2-methylthiophen-3-yl)methyl]pyridin-2-amine

C11H12N2S — CID 130671938

IUPACN-[(2-methylthiophen-3-yl)methyl]pyridin-2-amine
SMILESCc1sccc1CNc1ccccn1
InChIInChI=1S/C11H12N2S/c1-9-10(5-7-14-9)8-13-11-4-2-3-6-12-11/h2-7H,8H2,1H3,(H,12,13)
InChIKeyVAVUUJBYEBFOTI-UHFFFAOYSA-N
MW204.30 g/mol
LogP3.06
Rot. Bonds3

About N-[(2-methylthiophen-3-yl)methyl]pyridin-2-amine

N-[(2-methylthiophen-3-yl)methyl]pyridin-2-amine (PubChem CID 130671938) has the molecular formula C11H12N2S and a molecular weight of 204.30 g/mol. Its IUPAC name is N-[(2-methylthiophen-3-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-[(2-methylthiophen-3-yl)methyl]pyridin-2-amine
PubChem CID130671938
Molecular FormulaC11H12N2S
Molecular Weight204.30 g/mol
Exact Mass204.07
IUPAC NameN-[(2-methylthiophen-3-yl)methyl]pyridin-2-amine
SMILESCc1sccc1CNc1ccccn1
InChIInChI=1S/C11H12N2S/c1-9-10(5-7-14-9)8-13-11-4-2-3-6-12-11/h2-7H,8H2,1H3,(H,12,13)
InChIKeyVAVUUJBYEBFOTI-UHFFFAOYSA-N
XLogP3.06
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.30
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-methyl-3-pyridinyl)methyl]pyridin-2-amine
CID 115692595
N-[(2-ethylphenyl)methyl]pyridin-2-amine
CID 64695521
2-methyl-N-[(2-methylthiophen-3-yl)methyl]propan-2-amine
CID 102832538
N-[(4-methyl-3-pyridinyl)methyl]pyridin-2-amine
CID 91611248
N-[(5-methylthiophen-2-yl)methyl]pyridin-2-amine
CID 60962238
N-[(2-chloro-4-methylphenyl)methyl]pyridin-2-amine
CID 129211808
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]pyridin-2-amine
CID 115692578
N-[(4-tert-butylphenyl)methyl]pyridin-2-amine
CID 2228895
N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]pyridin-2-amine
CID 115589690
N-[[2-(2-methylpropoxy)phenyl]methyl]pyridin-2-amine
CID 133271435
N-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl]pyridin-2-amine
CID 115585005
2-[(pyridin-2-ylamino)methyl]benzene-1,3-diol
CID 45093433

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylthiophen-3-yl)methyl]pyridin-2-amine?
The IUPAC name of N-[(2-methylthiophen-3-yl)methyl]pyridin-2-amine (CID 130671938) is N-[(2-methylthiophen-3-yl)methyl]pyridin-2-amine.
What is the SMILES notation for N-[(2-methylthiophen-3-yl)methyl]pyridin-2-amine?
The canonical SMILES for N-[(2-methylthiophen-3-yl)methyl]pyridin-2-amine is Cc1sccc1CNc1ccccn1.
What is the InChIKey of N-[(2-methylthiophen-3-yl)methyl]pyridin-2-amine?
The InChIKey is VAVUUJBYEBFOTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2S/c1-9-10(5-7-14-9)8-13-11-4-2-3-6-12-11/h2-7H,8H2,1H3,(H,12,13).
What are the key properties of N-[(2-methylthiophen-3-yl)methyl]pyridin-2-amine?
N-[(2-methylthiophen-3-yl)methyl]pyridin-2-amine has a molecular weight of 204.30 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylthiophen-3-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 130671938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).