[2-(5-methylthiophen-2-yl)pyrimidin-5-yl]methanamine

C10H11N3S — CID 131067816

IUPAC[2-(5-methylthiophen-2-yl)pyrimidin-5-yl]methanamine
SMILESCc1ccc(-c2ncc(CN)cn2)s1
InChIInChI=1S/C10H11N3S/c1-7-2-3-9(14-7)10-12-5-8(4-11)6-13-10/h2-3,5-6H,4,11H2,1H3
InChIKeyHNSSUKRGJRDVQH-UHFFFAOYSA-N
MW205.29 g/mol
LogP1.97
Rot. Bonds2

About [2-(5-methylthiophen-2-yl)pyrimidin-5-yl]methanamine

[2-(5-methylthiophen-2-yl)pyrimidin-5-yl]methanamine (PubChem CID 131067816) has the molecular formula C10H11N3S and a molecular weight of 205.29 g/mol. Its IUPAC name is [2-(5-methylthiophen-2-yl)pyrimidin-5-yl]methanamine.

Molecular Properties

Compound Name[2-(5-methylthiophen-2-yl)pyrimidin-5-yl]methanamine
PubChem CID131067816
Molecular FormulaC10H11N3S
Molecular Weight205.29 g/mol
Exact Mass205.07
IUPAC Name[2-(5-methylthiophen-2-yl)pyrimidin-5-yl]methanamine
SMILESCc1ccc(-c2ncc(CN)cn2)s1
InChIInChI=1S/C10H11N3S/c1-7-2-3-9(14-7)10-12-5-8(4-11)6-13-10/h2-3,5-6H,4,11H2,1H3
InChIKeyHNSSUKRGJRDVQH-UHFFFAOYSA-N
XLogP1.97
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.29
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[5-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]methanamine
CID 130541584
4-methyl-2-(5-methylthiophen-2-yl)pyrimidin-5-amine
CID 130756454
ethane;2-methyl-5-(5-methylthiophen-2-yl)thiophene
CID 91463281
[2-(6-methyl-2-pyridinyl)pyrimidin-5-yl]methanamine
CID 63555986
2,5-bis[5-(5-methylthiophen-2-yl)thiophen-2-yl]pyrazine
CID 22960139
[2-(4-tert-butylphenyl)pyrimidin-5-yl]methanamine
CID 82293093
[2-(3-bromo-4-methylphenyl)pyrimidin-5-yl]methanamine
CID 107915560
2-(5-methylthiophen-2-yl)pyrido[2,3-d]pyrimidine
CID 141003087
ethane;[2-(5-methylthiophen-2-yl)phenyl]methanamine
CID 156737353
3,3-dimethylbutanal;[4-(5-methylthiophen-2-yl)phenyl]methanamine
CID 143422638
(6-methyl-3-pyridinyl)methanamine;hydrobromide
CID 133057273
5-bromo-N-methyl-2-(5-methylthiophen-2-yl)pyrimidin-4-amine
CID 66295477

Frequently Asked Questions

What is the IUPAC name of [2-(5-methylthiophen-2-yl)pyrimidin-5-yl]methanamine?
The IUPAC name of [2-(5-methylthiophen-2-yl)pyrimidin-5-yl]methanamine (CID 131067816) is [2-(5-methylthiophen-2-yl)pyrimidin-5-yl]methanamine.
What is the SMILES notation for [2-(5-methylthiophen-2-yl)pyrimidin-5-yl]methanamine?
The canonical SMILES for [2-(5-methylthiophen-2-yl)pyrimidin-5-yl]methanamine is Cc1ccc(-c2ncc(CN)cn2)s1.
What is the InChIKey of [2-(5-methylthiophen-2-yl)pyrimidin-5-yl]methanamine?
The InChIKey is HNSSUKRGJRDVQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3S/c1-7-2-3-9(14-7)10-12-5-8(4-11)6-13-10/h2-3,5-6H,4,11H2,1H3.
What are the key properties of [2-(5-methylthiophen-2-yl)pyrimidin-5-yl]methanamine?
[2-(5-methylthiophen-2-yl)pyrimidin-5-yl]methanamine has a molecular weight of 205.29 g/mol, XLogP of 1.97, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-methylthiophen-2-yl)pyrimidin-5-yl]methanamine is sourced from PubChem (CID 131067816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).