6-chloro-5-methyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine

C10H10ClN3S — CID 63729925

IUPAC6-chloro-5-methyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine
SMILESCc1c(Cl)ncnc1NCc1cccs1
InChIInChI=1S/C10H10ClN3S/c1-7-9(11)13-6-14-10(7)12-5-8-3-2-4-15-8/h2-4,6H,5H2,1H3,(H,12,13,14)
InChIKeyYGSVDFDKDKWJSV-UHFFFAOYSA-N
MW239.73 g/mol
LogP3.11
Rot. Bonds3

About 6-chloro-5-methyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine

6-chloro-5-methyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine (PubChem CID 63729925) has the molecular formula C10H10ClN3S and a molecular weight of 239.73 g/mol. Its IUPAC name is 6-chloro-5-methyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-chloro-5-methyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine
PubChem CID63729925
Molecular FormulaC10H10ClN3S
Molecular Weight239.73 g/mol
Exact Mass239.03
IUPAC Name6-chloro-5-methyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine
SMILESCc1c(Cl)ncnc1NCc1cccs1
InChIInChI=1S/C10H10ClN3S/c1-7-9(11)13-6-14-10(7)12-5-8-3-2-4-15-8/h2-4,6H,5H2,1H3,(H,12,13,14)
InChIKeyYGSVDFDKDKWJSV-UHFFFAOYSA-N
XLogP3.11
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.73
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-N,5-dimethyl-4-N-(thiophen-2-ylmethyl)pyrimidine-4,6-diamine
CID 80774342
6-methoxy-5-methyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine
CID 66324994
6-chloro-5-methyl-N-(thiophen-3-ylmethyl)pyrimidin-4-amine
CID 63729876
N-(thiophen-2-ylmethyl)quinazolin-4-amine
CID 4286982
6-chloro-N-ethyl-5-methylpyrimidin-4-amine
CID 63734594
3,5-dichloro-N-(thiophen-2-ylmethyl)pyridin-2-amine
CID 43242469
5-chloro-N-(thiophen-2-ylmethyl)pyrimidin-2-amine
CID 79557672
4-chloro-2-methyl-6-(thiophen-2-ylmethylamino)pyrimidine-5-carbaldehyde
CID 80732585
[3-[[(6-chloro-5-methylpyrimidin-4-yl)amino]methyl]phenyl]methanol
CID 114156936
6-chloro-4-N-(2-thiophen-2-ylethyl)pyrimidine-4,5-diamine
CID 23477636
5-nitro-6-N-propyl-4-N-(thiophen-2-ylmethyl)pyrimidine-4,6-diamine
CID 80771549
3-methyl-N-(thiophen-2-ylmethyl)quinoxalin-2-amine
CID 36590033

Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-methyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine?
The IUPAC name of 6-chloro-5-methyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine (CID 63729925) is 6-chloro-5-methyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-chloro-5-methyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine?
The canonical SMILES for 6-chloro-5-methyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine is Cc1c(Cl)ncnc1NCc1cccs1.
What is the InChIKey of 6-chloro-5-methyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine?
The InChIKey is YGSVDFDKDKWJSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN3S/c1-7-9(11)13-6-14-10(7)12-5-8-3-2-4-15-8/h2-4,6H,5H2,1H3,(H,12,13,14).
What are the key properties of 6-chloro-5-methyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine?
6-chloro-5-methyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine has a molecular weight of 239.73 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-methyl-N-(thiophen-2-ylmethyl)pyrimidin-4-amine is sourced from PubChem (CID 63729925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).