6-chloro-2-cyclopropyl-N-(2,6-dimethylpiperidin-1-yl)-5-methylpyrimidin-4-amine

C15H23ClN4 — CID 83020281

IUPAC6-chloro-2-cyclopropyl-N-(2,6-dimethylpiperidin-1-yl)-5-methylpyrimidin-4-amine
SMILESCc1c(Cl)nc(C2CC2)nc1NN1C(C)CCCC1C
InChIInChI=1S/C15H23ClN4/c1-9-5-4-6-10(2)20(9)19-14-11(3)13(16)17-15(18-14)12-7-8-12/h9-10,12H,4-8H2,1-3H3,(H,17,18,19)
InChIKeyJSMUJGQODNXPCZ-UHFFFAOYSA-N
MW294.83 g/mol
LogP3.91
Rot. Bonds3

About 6-chloro-2-cyclopropyl-N-(2,6-dimethylpiperidin-1-yl)-5-methylpyrimidin-4-amine

6-chloro-2-cyclopropyl-N-(2,6-dimethylpiperidin-1-yl)-5-methylpyrimidin-4-amine (PubChem CID 83020281) has the molecular formula C15H23ClN4 and a molecular weight of 294.83 g/mol. Its IUPAC name is 6-chloro-2-cyclopropyl-N-(2,6-dimethylpiperidin-1-yl)-5-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-chloro-2-cyclopropyl-N-(2,6-dimethylpiperidin-1-yl)-5-methylpyrimidin-4-amine
PubChem CID83020281
Molecular FormulaC15H23ClN4
Molecular Weight294.83 g/mol
Exact Mass294.16
IUPAC Name6-chloro-2-cyclopropyl-N-(2,6-dimethylpiperidin-1-yl)-5-methylpyrimidin-4-amine
SMILESCc1c(Cl)nc(C2CC2)nc1NN1C(C)CCCC1C
InChIInChI=1S/C15H23ClN4/c1-9-5-4-6-10(2)20(9)19-14-11(3)13(16)17-15(18-14)12-7-8-12/h9-10,12H,4-8H2,1-3H3,(H,17,18,19)
InChIKeyJSMUJGQODNXPCZ-UHFFFAOYSA-N
XLogP3.91
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.83
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N-(2,6-dimethylpiperidin-1-yl)-5-methylpyrimidin-4-amine
CID 83020197
6-chloro-N-cycloheptyl-2-cyclopropyl-5-methylpyrimidin-4-amine
CID 80970000
4-N-(2,6-dimethylpiperidin-1-yl)-2,5-dimethylpyrimidine-4,6-diamine
CID 83028090
6-chloro-2-cyclopropyl-5-methyl-N-prop-2-ynylpyrimidin-4-amine
CID 106194712
6-chloro-N-cyclopent-3-en-1-yl-2-cyclopropyl-5-methylpyrimidin-4-amine
CID 106196088
6-chloro-2-cyclopropyl-5-methyl-N-(oxolan-2-ylmethyl)pyrimidin-4-amine
CID 80970322
6-chloro-2-cyclopropyl-5-methyl-N-(1-methylpyrazol-3-yl)pyrimidin-4-amine
CID 80977609
2-cyclopropyl-4-N-(2,6-dimethylpiperidin-1-yl)pyrimidine-4,6-diamine
CID 83027612
6-chloro-2-cyclopropyl-5-methyl-N-[(3-methylcyclopentyl)methyl]pyrimidin-4-amine
CID 107414813
6-chloro-2-cyclopropyl-5-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrimidin-4-amine
CID 80971665
2-[(6-chloro-2-cyclopropyl-5-methylpyrimidin-4-yl)amino]-N-propan-2-ylacetamide
CID 80971282
6-chloro-2-cyclopropyl-N-(1-cyclopropylpyrrolidin-3-yl)-5-methylpyrimidin-4-amine
CID 80972393

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-cyclopropyl-N-(2,6-dimethylpiperidin-1-yl)-5-methylpyrimidin-4-amine?
The IUPAC name of 6-chloro-2-cyclopropyl-N-(2,6-dimethylpiperidin-1-yl)-5-methylpyrimidin-4-amine (CID 83020281) is 6-chloro-2-cyclopropyl-N-(2,6-dimethylpiperidin-1-yl)-5-methylpyrimidin-4-amine.
What is the SMILES notation for 6-chloro-2-cyclopropyl-N-(2,6-dimethylpiperidin-1-yl)-5-methylpyrimidin-4-amine?
The canonical SMILES for 6-chloro-2-cyclopropyl-N-(2,6-dimethylpiperidin-1-yl)-5-methylpyrimidin-4-amine is Cc1c(Cl)nc(C2CC2)nc1NN1C(C)CCCC1C.
What is the InChIKey of 6-chloro-2-cyclopropyl-N-(2,6-dimethylpiperidin-1-yl)-5-methylpyrimidin-4-amine?
The InChIKey is JSMUJGQODNXPCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23ClN4/c1-9-5-4-6-10(2)20(9)19-14-11(3)13(16)17-15(18-14)12-7-8-12/h9-10,12H,4-8H2,1-3H3,(H,17,18,19).
What are the key properties of 6-chloro-2-cyclopropyl-N-(2,6-dimethylpiperidin-1-yl)-5-methylpyrimidin-4-amine?
6-chloro-2-cyclopropyl-N-(2,6-dimethylpiperidin-1-yl)-5-methylpyrimidin-4-amine has a molecular weight of 294.83 g/mol, XLogP of 3.91, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-cyclopropyl-N-(2,6-dimethylpiperidin-1-yl)-5-methylpyrimidin-4-amine is sourced from PubChem (CID 83020281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).