4-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-2-carboxamide

C15H24N4O — CID 134505664

IUPAC4-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-2-carboxamide
SMILESCc1ccnc(C(=O)NC2(C)CCN(C(C)C)CC2)n1
InChIInChI=1S/C15H24N4O/c1-11(2)19-9-6-15(4,7-10-19)18-14(20)13-16-8-5-12(3)17-13/h5,8,11H,6-7,9-10H2,1-4H3,(H,18,20)
InChIKeyJLLGQXIAYRFIKE-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.78
Rot. Bonds3

About 4-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-2-carboxamide

4-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-2-carboxamide (PubChem CID 134505664) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 4-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-2-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-2-carboxamide
PubChem CID134505664
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name4-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-2-carboxamide
SMILESCc1ccnc(C(=O)NC2(C)CCN(C(C)C)CC2)n1
InChIInChI=1S/C15H24N4O/c1-11(2)19-9-6-15(4,7-10-19)18-14(20)13-16-8-5-12(3)17-13/h5,8,11H,6-7,9-10H2,1-4H3,(H,18,20)
InChIKeyJLLGQXIAYRFIKE-UHFFFAOYSA-N
XLogP1.78
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-1-(4-methyl-2-pyrimidinyl)-3-piperidinecarboxamide
CID 24792325
1-(4-Methyl-pyrimidin-2-yl)-piperidine-4-carboxylic acid cycloheptylamide
CID 646431
1-(4-Methyl-2-pyrimidinyl)-4-piperidinecarboxamide
CID 91406466
N-tert-butyl-4-[[4-(trifluoromethyl)pyrimidin-2-yl]amino]piperidine-1-carboxamide
CID 2796053
N-{[4-(dimethylamino)-1-ethylpiperidin-4-yl]methyl}-4-methylpyrimidin-2-amine
CID 72912703
1-[2-(4-Methylpyrimidin-2-yl)pyrrolidin-1-yl]ethanone
CID 73439401
2-(Dimethylamino)-1-[2-(4-methylpyrimidin-2-yl)pyrrolidin-1-yl]ethanone
CID 73440182
3-Ethyl-4-(6-methylpyrimidin-4-yl)piperazin-2-one
CID 75379309
3-Ethyl-4-(4-methylpyrimidin-2-yl)piperazin-2-one
CID 75379310
2-(Methylamino)-1-[3-[2-methyl-6-(pyrimidin-2-ylamino)pyrimidin-4-yl]azetidin-1-yl]ethanone
CID 95842862
1-[2-(4-Methylpyrimidin-2-yl)piperidin-1-yl]butan-1-one
CID 110256003
2-(Methylamino)-1-[2-(4-methylpyrimidin-2-yl)piperidin-1-yl]ethanone
CID 110269942

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-2-carboxamide?
The IUPAC name of 4-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-2-carboxamide (CID 134505664) is 4-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-2-carboxamide.
What is the SMILES notation for 4-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-2-carboxamide?
The canonical SMILES for 4-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-2-carboxamide is Cc1ccnc(C(=O)NC2(C)CCN(C(C)C)CC2)n1.
What is the InChIKey of 4-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-2-carboxamide?
The InChIKey is JLLGQXIAYRFIKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-11(2)19-9-6-15(4,7-10-19)18-14(20)13-16-8-5-12(3)17-13/h5,8,11H,6-7,9-10H2,1-4H3,(H,18,20).
What are the key properties of 4-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-2-carboxamide?
4-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-2-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrimidine-2-carboxamide is sourced from PubChem (CID 134505664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).