N-methyl-N-(1-pyrimidin-4-ylpiperidin-4-yl)imidazole-1-carboxamide

C14H18N6O — CID 144864039

IUPACN-methyl-N-(1-pyrimidin-4-ylpiperidin-4-yl)imidazole-1-carboxamide
SMILESCN(C(=O)n1ccnc1)C1CCN(c2ccncn2)CC1
InChIInChI=1S/C14H18N6O/c1-18(14(21)20-9-6-16-11-20)12-3-7-19(8-4-12)13-2-5-15-10-17-13/h2,5-6,9-12H,3-4,7-8H2,1H3
InChIKeyHREIWMAKYGGCJE-UHFFFAOYSA-N
MW286.34 g/mol
LogP1.24
Rot. Bonds2

About N-methyl-N-(1-pyrimidin-4-ylpiperidin-4-yl)imidazole-1-carboxamide

N-methyl-N-(1-pyrimidin-4-ylpiperidin-4-yl)imidazole-1-carboxamide (PubChem CID 144864039) has the molecular formula C14H18N6O and a molecular weight of 286.34 g/mol. Its IUPAC name is N-methyl-N-(1-pyrimidin-4-ylpiperidin-4-yl)imidazole-1-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(1-pyrimidin-4-ylpiperidin-4-yl)imidazole-1-carboxamide
PubChem CID144864039
Molecular FormulaC14H18N6O
Molecular Weight286.34 g/mol
Exact Mass286.15
IUPAC NameN-methyl-N-(1-pyrimidin-4-ylpiperidin-4-yl)imidazole-1-carboxamide
SMILESCN(C(=O)n1ccnc1)C1CCN(c2ccncn2)CC1
InChIInChI=1S/C14H18N6O/c1-18(14(21)20-9-6-16-11-20)12-3-7-19(8-4-12)13-2-5-15-10-17-13/h2,5-6,9-12H,3-4,7-8H2,1H3
InChIKeyHREIWMAKYGGCJE-UHFFFAOYSA-N
XLogP1.24
TPSA67.15 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-pyrimidin-4-ylpiperidin-4-yl)imidazole-1-carboxamide?
The IUPAC name of N-methyl-N-(1-pyrimidin-4-ylpiperidin-4-yl)imidazole-1-carboxamide (CID 144864039) is N-methyl-N-(1-pyrimidin-4-ylpiperidin-4-yl)imidazole-1-carboxamide.
What is the SMILES notation for N-methyl-N-(1-pyrimidin-4-ylpiperidin-4-yl)imidazole-1-carboxamide?
The canonical SMILES for N-methyl-N-(1-pyrimidin-4-ylpiperidin-4-yl)imidazole-1-carboxamide is CN(C(=O)n1ccnc1)C1CCN(c2ccncn2)CC1.
What is the InChIKey of N-methyl-N-(1-pyrimidin-4-ylpiperidin-4-yl)imidazole-1-carboxamide?
The InChIKey is HREIWMAKYGGCJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N6O/c1-18(14(21)20-9-6-16-11-20)12-3-7-19(8-4-12)13-2-5-15-10-17-13/h2,5-6,9-12H,3-4,7-8H2,1H3.
What are the key properties of N-methyl-N-(1-pyrimidin-4-ylpiperidin-4-yl)imidazole-1-carboxamide?
N-methyl-N-(1-pyrimidin-4-ylpiperidin-4-yl)imidazole-1-carboxamide has a molecular weight of 286.34 g/mol, XLogP of 1.24, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-pyrimidin-4-ylpiperidin-4-yl)imidazole-1-carboxamide is sourced from PubChem (CID 144864039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).