4-chloro-N-methyl-6-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]pyrimidin-5-amine

C14H19ClN6 — CID 133464294

IUPAC4-chloro-N-methyl-6-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]pyrimidin-5-amine
SMILESCNc1c(Cl)ncnc1N1CCC(c2cnn(C)c2)CC1
InChIInChI=1S/C14H19ClN6/c1-16-12-13(15)17-9-18-14(12)21-5-3-10(4-6-21)11-7-19-20(2)8-11/h7-10,16H,3-6H2,1-2H3
InChIKeyUJWVVLSXXJXPQT-UHFFFAOYSA-N
MW306.80 g/mol
LogP2.29
Rot. Bonds3

About 4-chloro-N-methyl-6-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]pyrimidin-5-amine

4-chloro-N-methyl-6-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]pyrimidin-5-amine (PubChem CID 133464294) has the molecular formula C14H19ClN6 and a molecular weight of 306.80 g/mol. Its IUPAC name is 4-chloro-N-methyl-6-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]pyrimidin-5-amine.

Molecular Properties

Compound Name4-chloro-N-methyl-6-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]pyrimidin-5-amine
PubChem CID133464294
Molecular FormulaC14H19ClN6
Molecular Weight306.80 g/mol
Exact Mass306.14
IUPAC Name4-chloro-N-methyl-6-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]pyrimidin-5-amine
SMILESCNc1c(Cl)ncnc1N1CCC(c2cnn(C)c2)CC1
InChIInChI=1S/C14H19ClN6/c1-16-12-13(15)17-9-18-14(12)21-5-3-10(4-6-21)11-7-19-20(2)8-11/h7-10,16H,3-6H2,1-2H3
InChIKeyUJWVVLSXXJXPQT-UHFFFAOYSA-N
XLogP2.29
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.80
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-chloro-N-methyl-6-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]pyrimidin-5-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-chloro-N-methyl-6-[4-(oxan-4-yloxy)piperidin-1-yl]pyrimidin-5-amine
CID 133464624
4-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]thieno[3,2-d]pyrimidine
CID 86773022
6-methyl-4-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]quinazoline
CID 133300671
6-fluoro-4-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]quinazoline
CID 133300706
4-chloro-N-methyl-6-[(2R)-2-[(2S)-oxolan-2-yl]morpholin-4-yl]pyrimidin-5-amine
CID 99609076
[5-chloro-6-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]-3-pyridinyl]-morpholin-4-ylmethanone
CID 133300707
2-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]-3-(trifluoromethyl)pyridine
CID 133300594
4-(1-methylpyrazol-4-yl)-1-(4-nitrophenyl)piperidine
CID 133300632
1-(4-ethylsulfonylphenyl)-4-(1-methylpyrazol-4-yl)piperidine
CID 91651135
4-chloro-N-methyl-6-[4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperazin-1-yl]pyrimidin-5-amine
CID 133464425
2-[4-ethyl-5-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]-1,2,4-triazol-3-yl]pyrimidine
CID 154783841
N-methyl-3-(1-methylpyrazol-4-yl)cyclopentan-1-amine
CID 64505429

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-methyl-6-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]pyrimidin-5-amine?
The IUPAC name of 4-chloro-N-methyl-6-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]pyrimidin-5-amine (CID 133464294) is 4-chloro-N-methyl-6-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]pyrimidin-5-amine.
What is the SMILES notation for 4-chloro-N-methyl-6-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]pyrimidin-5-amine?
The canonical SMILES for 4-chloro-N-methyl-6-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]pyrimidin-5-amine is CNc1c(Cl)ncnc1N1CCC(c2cnn(C)c2)CC1.
What is the InChIKey of 4-chloro-N-methyl-6-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]pyrimidin-5-amine?
The InChIKey is UJWVVLSXXJXPQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN6/c1-16-12-13(15)17-9-18-14(12)21-5-3-10(4-6-21)11-7-19-20(2)8-11/h7-10,16H,3-6H2,1-2H3.
What are the key properties of 4-chloro-N-methyl-6-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]pyrimidin-5-amine?
4-chloro-N-methyl-6-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]pyrimidin-5-amine has a molecular weight of 306.80 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-methyl-6-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]pyrimidin-5-amine is sourced from PubChem (CID 133464294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).