N,N-dimethyl-4-[4-(5-methyl-1,3-thiazol-2-yl)piperidin-1-yl]pyrimidin-2-amine

C15H21N5S — CID 136536439

IUPACN,N-dimethyl-4-[4-(5-methyl-1,3-thiazol-2-yl)piperidin-1-yl]pyrimidin-2-amine
SMILESCc1cnc(C2CCN(c3ccnc(N(C)C)n3)CC2)s1
InChIInChI=1S/C15H21N5S/c1-11-10-17-14(21-11)12-5-8-20(9-6-12)13-4-7-16-15(18-13)19(2)3/h4,7,10,12H,5-6,8-9H2,1-3H3
InChIKeyPXUSPTNLSOVCEA-UHFFFAOYSA-N
MW303.44 g/mol
LogP2.69
Rot. Bonds3

About N,N-dimethyl-4-[4-(5-methyl-1,3-thiazol-2-yl)piperidin-1-yl]pyrimidin-2-amine

N,N-dimethyl-4-[4-(5-methyl-1,3-thiazol-2-yl)piperidin-1-yl]pyrimidin-2-amine (PubChem CID 136536439) has the molecular formula C15H21N5S and a molecular weight of 303.44 g/mol. Its IUPAC name is N,N-dimethyl-4-[4-(5-methyl-1,3-thiazol-2-yl)piperidin-1-yl]pyrimidin-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-4-[4-(5-methyl-1,3-thiazol-2-yl)piperidin-1-yl]pyrimidin-2-amine
PubChem CID136536439
Molecular FormulaC15H21N5S
Molecular Weight303.44 g/mol
Exact Mass303.15
IUPAC NameN,N-dimethyl-4-[4-(5-methyl-1,3-thiazol-2-yl)piperidin-1-yl]pyrimidin-2-amine
SMILESCc1cnc(C2CCN(c3ccnc(N(C)C)n3)CC2)s1
InChIInChI=1S/C15H21N5S/c1-11-10-17-14(21-11)12-5-8-20(9-6-12)13-4-7-16-15(18-13)19(2)3/h4,7,10,12H,5-6,8-9H2,1-3H3
InChIKeyPXUSPTNLSOVCEA-UHFFFAOYSA-N
XLogP2.69
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.44
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N,N-dimethyl-4-[4-(5-methyl-1,3-thiazol-2-yl)piperidin-1-yl]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

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[4-(5-methyl-1,3-thiazol-2-yl)piperidin-1-yl]pyrimidin-2-amine?
The IUPAC name of N,N-dimethyl-4-[4-(5-methyl-1,3-thiazol-2-yl)piperidin-1-yl]pyrimidin-2-amine (CID 136536439) is N,N-dimethyl-4-[4-(5-methyl-1,3-thiazol-2-yl)piperidin-1-yl]pyrimidin-2-amine.
What is the SMILES notation for N,N-dimethyl-4-[4-(5-methyl-1,3-thiazol-2-yl)piperidin-1-yl]pyrimidin-2-amine?
The canonical SMILES for N,N-dimethyl-4-[4-(5-methyl-1,3-thiazol-2-yl)piperidin-1-yl]pyrimidin-2-amine is Cc1cnc(C2CCN(c3ccnc(N(C)C)n3)CC2)s1.
What is the InChIKey of N,N-dimethyl-4-[4-(5-methyl-1,3-thiazol-2-yl)piperidin-1-yl]pyrimidin-2-amine?
The InChIKey is PXUSPTNLSOVCEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5S/c1-11-10-17-14(21-11)12-5-8-20(9-6-12)13-4-7-16-15(18-13)19(2)3/h4,7,10,12H,5-6,8-9H2,1-3H3.
What are the key properties of N,N-dimethyl-4-[4-(5-methyl-1,3-thiazol-2-yl)piperidin-1-yl]pyrimidin-2-amine?
N,N-dimethyl-4-[4-(5-methyl-1,3-thiazol-2-yl)piperidin-1-yl]pyrimidin-2-amine has a molecular weight of 303.44 g/mol, XLogP of 2.69, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[4-(5-methyl-1,3-thiazol-2-yl)piperidin-1-yl]pyrimidin-2-amine is sourced from PubChem (CID 136536439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).