1-(4,6-dimethylpyrimidin-2-yl)-N-(1H-imidazol-2-yl)piperidine-4-carboxamide

C15H20N6O — CID 71708842

IUPAC1-(4,6-dimethylpyrimidin-2-yl)-N-(1H-imidazol-2-yl)piperidine-4-carboxamide
SMILESCc1cc(C)nc(N2CCC(C(=O)Nc3ncc[nH]3)CC2)n1
InChIInChI=1S/C15H20N6O/c1-10-9-11(2)19-15(18-10)21-7-3-12(4-8-21)13(22)20-14-16-5-6-17-14/h5-6,9,12H,3-4,7-8H2,1-2H3,(H2,16,17,20,22)
InChIKeySORQUVGPFUTOEB-UHFFFAOYSA-N
MW300.37 g/mol
LogP1.67
Rot. Bonds3

About 1-(4,6-dimethylpyrimidin-2-yl)-N-(1H-imidazol-2-yl)piperidine-4-carboxamide

1-(4,6-dimethylpyrimidin-2-yl)-N-(1H-imidazol-2-yl)piperidine-4-carboxamide (PubChem CID 71708842) has the molecular formula C15H20N6O and a molecular weight of 300.37 g/mol. Its IUPAC name is 1-(4,6-dimethylpyrimidin-2-yl)-N-(1H-imidazol-2-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4,6-dimethylpyrimidin-2-yl)-N-(1H-imidazol-2-yl)piperidine-4-carboxamide
PubChem CID71708842
Molecular FormulaC15H20N6O
Molecular Weight300.37 g/mol
Exact Mass300.17
IUPAC Name1-(4,6-dimethylpyrimidin-2-yl)-N-(1H-imidazol-2-yl)piperidine-4-carboxamide
SMILESCc1cc(C)nc(N2CCC(C(=O)Nc3ncc[nH]3)CC2)n1
InChIInChI=1S/C15H20N6O/c1-10-9-11(2)19-15(18-10)21-7-3-12(4-8-21)13(22)20-14-16-5-6-17-14/h5-6,9,12H,3-4,7-8H2,1-2H3,(H2,16,17,20,22)
InChIKeySORQUVGPFUTOEB-UHFFFAOYSA-N
XLogP1.67
TPSA86.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.37
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(4,6-dimethylpyrimidin-2-yl)amino]-N-[2-(2-methylimidazol-1-yl)ethyl]propanamide
CID 46981387
N-({1-[(4-methyl-1H-imidazol-5-yl)methyl]piperidin-3-yl}methyl)pyrimidine-4-carboxamide
CID 56714156
4-[4-(1H-imidazol-2-yl)-1-piperidinyl]-6-methyl-2-pyrimidinamine
CID 70768454
2-(1H-imidazol-5-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone
CID 110684121
1-[3-[2-(Pyrazin-2-ylamino)pyrimidin-4-yl]pyrrolidin-1-yl]ethanone
CID 118740404
1-[3-[2-(Pyrimidin-5-ylamino)pyrimidin-4-yl]pyrrolidin-1-yl]ethanone
CID 118740405
N-[2-(diethylamino)ethyl]-1-(4-methylpyrimidin-2-yl)piperidine-4-carboxamide
CID 53102122
1-(4-methylpyrimidin-2-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]piperidine-4-carboxamide
CID 53102132
((1S)-1-(1H-imidazol-4-ylmethyl)-2-oxo-2-{4-[6-(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperidinyl}ethyl)amine
CID 70770812
4-Ethyl-6-[4-(1H-imidazol-2-ylmethyl)piperazin-1-YL]pyrimidine
CID 77085367
(6R)-8-(4,6-dimethylpyrimidin-2-yl)-2-[2-(1H-imidazol-5-yl)ethyl]-2,8-diazaspiro[5.5]undecan-3-one
CID 96364956
3-[(4,6-dimethylpyrimidin-2-yl)amino]-N-[2-(2-methylimidazol-1-yl)ethyl]propanamide;hydrobromide
CID 118747461

Frequently Asked Questions

What is the IUPAC name of 1-(4,6-dimethylpyrimidin-2-yl)-N-(1H-imidazol-2-yl)piperidine-4-carboxamide?
The IUPAC name of 1-(4,6-dimethylpyrimidin-2-yl)-N-(1H-imidazol-2-yl)piperidine-4-carboxamide (CID 71708842) is 1-(4,6-dimethylpyrimidin-2-yl)-N-(1H-imidazol-2-yl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(4,6-dimethylpyrimidin-2-yl)-N-(1H-imidazol-2-yl)piperidine-4-carboxamide?
The canonical SMILES for 1-(4,6-dimethylpyrimidin-2-yl)-N-(1H-imidazol-2-yl)piperidine-4-carboxamide is Cc1cc(C)nc(N2CCC(C(=O)Nc3ncc[nH]3)CC2)n1.
What is the InChIKey of 1-(4,6-dimethylpyrimidin-2-yl)-N-(1H-imidazol-2-yl)piperidine-4-carboxamide?
The InChIKey is SORQUVGPFUTOEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6O/c1-10-9-11(2)19-15(18-10)21-7-3-12(4-8-21)13(22)20-14-16-5-6-17-14/h5-6,9,12H,3-4,7-8H2,1-2H3,(H2,16,17,20,22).
What are the key properties of 1-(4,6-dimethylpyrimidin-2-yl)-N-(1H-imidazol-2-yl)piperidine-4-carboxamide?
1-(4,6-dimethylpyrimidin-2-yl)-N-(1H-imidazol-2-yl)piperidine-4-carboxamide has a molecular weight of 300.37 g/mol, XLogP of 1.67, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,6-dimethylpyrimidin-2-yl)-N-(1H-imidazol-2-yl)piperidine-4-carboxamide is sourced from PubChem (CID 71708842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).