4-chloro-N-methyl-6-piperidin-1-ylpyrimidin-2-amine

C10H15ClN4 — CID 123974719

IUPAC4-chloro-N-methyl-6-piperidin-1-ylpyrimidin-2-amine
SMILESCNc1nc(Cl)cc(N2CCCCC2)n1
InChIInChI=1S/C10H15ClN4/c1-12-10-13-8(11)7-9(14-10)15-5-3-2-4-6-15/h7H,2-6H2,1H3,(H,12,13,14)
InChIKeyFSSXXPIZAFTQHP-UHFFFAOYSA-N
MW226.71 g/mol
LogP2.16
Rot. Bonds2

About 4-chloro-N-methyl-6-piperidin-1-ylpyrimidin-2-amine

4-chloro-N-methyl-6-piperidin-1-ylpyrimidin-2-amine (PubChem CID 123974719) has the molecular formula C10H15ClN4 and a molecular weight of 226.71 g/mol. Its IUPAC name is 4-chloro-N-methyl-6-piperidin-1-ylpyrimidin-2-amine.

Molecular Properties

Compound Name4-chloro-N-methyl-6-piperidin-1-ylpyrimidin-2-amine
PubChem CID123974719
Molecular FormulaC10H15ClN4
Molecular Weight226.71 g/mol
Exact Mass226.10
IUPAC Name4-chloro-N-methyl-6-piperidin-1-ylpyrimidin-2-amine
SMILESCNc1nc(Cl)cc(N2CCCCC2)n1
InChIInChI=1S/C10H15ClN4/c1-12-10-13-8(11)7-9(14-10)15-5-3-2-4-6-15/h7H,2-6H2,1H3,(H,12,13,14)
InChIKeyFSSXXPIZAFTQHP-UHFFFAOYSA-N
XLogP2.16
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.71
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-chloro-6-pyrrolidin-1-ylpyrimidin-2-yl)-3-methylthiourea
CID 100773732
1-(6-chloro-2-methylpyrimidin-4-yl)azepane
CID 62480915
1-[4-(azepan-1-yl)-6-chloropyrimidin-2-yl]-3-propan-2-ylthiourea
CID 100775606
4-chloro-N-cyclopentyl-6-pyrrolidin-1-ylpyrimidin-2-amine
CID 19428512
4-[(4-chloro-6-piperidin-1-ylpyrimidin-2-yl)amino]cyclohexan-1-ol
CID 169246456
N-(4-chloro-6-piperidin-1-ylpyrimidin-2-yl)-4-methoxybenzenesulfonamide
CID 88570952
1-[4-(azepan-1-yl)-6-chloropyrimidin-2-yl]-3-cyclohexylthiourea
CID 100791148
1-[4-(azepan-1-yl)-6-chloropyrimidin-2-yl]-3-[(4-methylphenyl)methyl]thiourea
CID 100783153
2-N-methyl-6-pyrrolidin-1-ylpyridine-2,4-diamine
CID 10241677
4-chloro-6-pyrrolidin-1-ylpyrimidine-2-carbonitrile
CID 175640213
1-[(2-chlorophenyl)methyl]-3-(4-chloro-6-piperidin-1-ylpyrimidin-2-yl)thiourea
CID 100782129
4-chloro-2-(4-methylpiperidin-1-yl)-6-pyrrolidin-1-ylpyrimidine
CID 166460131

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-methyl-6-piperidin-1-ylpyrimidin-2-amine?
The IUPAC name of 4-chloro-N-methyl-6-piperidin-1-ylpyrimidin-2-amine (CID 123974719) is 4-chloro-N-methyl-6-piperidin-1-ylpyrimidin-2-amine.
What is the SMILES notation for 4-chloro-N-methyl-6-piperidin-1-ylpyrimidin-2-amine?
The canonical SMILES for 4-chloro-N-methyl-6-piperidin-1-ylpyrimidin-2-amine is CNc1nc(Cl)cc(N2CCCCC2)n1.
What is the InChIKey of 4-chloro-N-methyl-6-piperidin-1-ylpyrimidin-2-amine?
The InChIKey is FSSXXPIZAFTQHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN4/c1-12-10-13-8(11)7-9(14-10)15-5-3-2-4-6-15/h7H,2-6H2,1H3,(H,12,13,14).
What are the key properties of 4-chloro-N-methyl-6-piperidin-1-ylpyrimidin-2-amine?
4-chloro-N-methyl-6-piperidin-1-ylpyrimidin-2-amine has a molecular weight of 226.71 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-methyl-6-piperidin-1-ylpyrimidin-2-amine is sourced from PubChem (CID 123974719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).