N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,3-dimethylimidazole-4-carboxamide

C17H24N6O — CID 126816387

IUPACN-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,3-dimethylimidazole-4-carboxamide
SMILESCc1cc(N2CCC(N(C)C(=O)c3cncn3C)CC2)nc(C)n1
InChIInChI=1S/C17H24N6O/c1-12-9-16(20-13(2)19-12)23-7-5-14(6-8-23)22(4)17(24)15-10-18-11-21(15)3/h9-11,14H,5-8H2,1-4H3
InChIKeyGJMCOQXAGKVHTL-UHFFFAOYSA-N
MW328.42 g/mol
LogP1.57
Rot. Bonds3

About N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,3-dimethylimidazole-4-carboxamide

N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,3-dimethylimidazole-4-carboxamide (PubChem CID 126816387) has the molecular formula C17H24N6O and a molecular weight of 328.42 g/mol. Its IUPAC name is N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,3-dimethylimidazole-4-carboxamide.

Molecular Properties

Compound NameN-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,3-dimethylimidazole-4-carboxamide
PubChem CID126816387
Molecular FormulaC17H24N6O
Molecular Weight328.42 g/mol
Exact Mass328.20
IUPAC NameN-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,3-dimethylimidazole-4-carboxamide
SMILESCc1cc(N2CCC(N(C)C(=O)c3cncn3C)CC2)nc(C)n1
InChIInChI=1S/C17H24N6O/c1-12-9-16(20-13(2)19-12)23-7-5-14(6-8-23)22(4)17(24)15-10-18-11-21(15)3/h9-11,14H,5-8H2,1-4H3
InChIKeyGJMCOQXAGKVHTL-UHFFFAOYSA-N
XLogP1.57
TPSA67.15 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-2,2-difluoro-2-(1-hydroxycyclopentyl)-N-methylacetamide
CID 154756267
3-(2,5-dichlorophenyl)-1-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-1-methylurea
CID 99798806
1,1,3-trimethyl-3-[1-(6-methyl-2-methylsulfanylpyrimidin-4-yl)piperidin-4-yl]urea
CID 166603402
(1R)-2-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-methylamino]-1-phenylethanol
CID 97069243
(3R)-N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-3-[hexanoyl(methyl)amino]-N-methyl-2,3-dihydro-1H-indene-5-carboxamide
CID 174692026
N-[1-(2-cyclopropyl-6-methylpyrimidin-4-yl)piperidin-4-yl]-N-methylmorpholine-4-carboxamide
CID 172892797
2-[2-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-methylamino]ethoxy]ethanol
CID 111543569
cis-(1R,2S)-N,2-dimethyl-N-[1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperidin-4-yl]cyclopropane-1-carboxamide
CID 95318242
N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-6-methylpyridine-3-carboxamide
CID 71977383
N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-4-(propan-2-ylamino)piperidine-1-carboxamide
CID 126778638
N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N-methyl-1,2,4-thiadiazol-5-amine
CID 86805479
N-methyl-N-[1-(6-methylpyrazin-2-yl)piperidin-4-yl]-2,3-dihydro-1H-indene-5-carboxamide
CID 123712985

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,3-dimethylimidazole-4-carboxamide?
The IUPAC name of N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,3-dimethylimidazole-4-carboxamide (CID 126816387) is N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,3-dimethylimidazole-4-carboxamide.
What is the SMILES notation for N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,3-dimethylimidazole-4-carboxamide?
The canonical SMILES for N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,3-dimethylimidazole-4-carboxamide is Cc1cc(N2CCC(N(C)C(=O)c3cncn3C)CC2)nc(C)n1.
What is the InChIKey of N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,3-dimethylimidazole-4-carboxamide?
The InChIKey is GJMCOQXAGKVHTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N6O/c1-12-9-16(20-13(2)19-12)23-7-5-14(6-8-23)22(4)17(24)15-10-18-11-21(15)3/h9-11,14H,5-8H2,1-4H3.
What are the key properties of N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,3-dimethylimidazole-4-carboxamide?
N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,3-dimethylimidazole-4-carboxamide has a molecular weight of 328.42 g/mol, XLogP of 1.57, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]-N,3-dimethylimidazole-4-carboxamide is sourced from PubChem (CID 126816387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).