4-methyl-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]pyrimidin-2-amine

C14H19N5S — CID 75374195

IUPAC4-methyl-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]pyrimidin-2-amine
SMILESCc1ccnc(NCCc2csc(N3CCCC3)n2)n1
InChIInChI=1S/C14H19N5S/c1-11-4-6-15-13(17-11)16-7-5-12-10-20-14(18-12)19-8-2-3-9-19/h4,6,10H,2-3,5,7-9H2,1H3,(H,15,16,17)
InChIKeyTZJQSDHFSOQVSN-UHFFFAOYSA-N
MW289.41 g/mol
LogP2.50
Rot. Bonds5

About 4-methyl-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]pyrimidin-2-amine

4-methyl-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]pyrimidin-2-amine (PubChem CID 75374195) has the molecular formula C14H19N5S and a molecular weight of 289.41 g/mol. Its IUPAC name is 4-methyl-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]pyrimidin-2-amine.

Molecular Properties

Compound Name4-methyl-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]pyrimidin-2-amine
PubChem CID75374195
Molecular FormulaC14H19N5S
Molecular Weight289.41 g/mol
Exact Mass289.14
IUPAC Name4-methyl-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]pyrimidin-2-amine
SMILESCc1ccnc(NCCc2csc(N3CCCC3)n2)n1
InChIInChI=1S/C14H19N5S/c1-11-4-6-15-13(17-11)16-7-5-12-10-20-14(18-12)19-8-2-3-9-19/h4,6,10H,2-3,5,7-9H2,1H3,(H,15,16,17)
InChIKeyTZJQSDHFSOQVSN-UHFFFAOYSA-N
XLogP2.50
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.41
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-methyl-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]pyrimidin-2-amine 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

4-(1,3-Thiazol-2-yl)pyrimidin-2-amine
CID 4131872
4-(aminomethyl)-N-pyrimidin-2-yl-1,3-thiazol-2-amine
CID 49778112
4-(1-aminoethyl)-N-pyrimidin-2-yl-1,3-thiazol-2-amine
CID 49791397
Ethanamine, N,N-dimethyl-2-((4-(2-thiazolyl)-2-pyrimidinyl)thio)-
CID 452514
1,2-Ethanediamine, N,N-dimethyl-N'-(4-(2-thiazolyl)-2-pyrimidinyl)-
CID 452515
1-[2-(2-Methyl-1,3-thiazol-4-yl)ethyl]-3-(1-pyrimidin-2-ylpiperidin-4-yl)urea
CID 45827799
4-(1-aminoethyl)-N-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3-thiazol-2-amine
CID 49795542
N-[2-(4-ethyl-5-methyl-1,3-thiazol-2-yl)ethyl]pyrimidin-2-amine
CID 53576345
4-Methyl-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-1,3-thiazole
CID 60393934
N-methyl-6-[2-[[(2-methyl-1,3-thiazol-4-yl)methylamino]methyl]pyrrolidin-1-yl]pyrimidin-4-amine
CID 72043839
N-methyl-6-[2-[(1,3-thiazol-4-ylmethylamino)methyl]pyrrolidin-1-yl]pyrimidin-4-amine
CID 72144339
N-Methyl-N-[(2-methyl-1,3-thiazol-4-YL)methyl]-4-(trifluoromethyl)pyrimidin-2-amine
CID 72880410

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]pyrimidin-2-amine?
The IUPAC name of 4-methyl-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]pyrimidin-2-amine (CID 75374195) is 4-methyl-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]pyrimidin-2-amine.
What is the SMILES notation for 4-methyl-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]pyrimidin-2-amine?
The canonical SMILES for 4-methyl-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]pyrimidin-2-amine is Cc1ccnc(NCCc2csc(N3CCCC3)n2)n1.
What is the InChIKey of 4-methyl-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]pyrimidin-2-amine?
The InChIKey is TZJQSDHFSOQVSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5S/c1-11-4-6-15-13(17-11)16-7-5-12-10-20-14(18-12)19-8-2-3-9-19/h4,6,10H,2-3,5,7-9H2,1H3,(H,15,16,17).
What are the key properties of 4-methyl-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]pyrimidin-2-amine?
4-methyl-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]pyrimidin-2-amine has a molecular weight of 289.41 g/mol, XLogP of 2.50, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]pyrimidin-2-amine is sourced from PubChem (CID 75374195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).