N-methyl-N-(1-methylpiperidin-4-yl)-1H-imidazole-5-carboxamide

C11H18N4O — CID 110475288

IUPACN-methyl-N-(1-methylpiperidin-4-yl)-1H-imidazole-5-carboxamide
SMILESCN1CCC(N(C)C(=O)c2cnc[nH]2)CC1
InChIInChI=1S/C11H18N4O/c1-14-5-3-9(4-6-14)15(2)11(16)10-7-12-8-13-10/h7-9H,3-6H2,1-2H3,(H,12,13)
InChIKeyIGQRZCFSUZCKPA-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.58
Rot. Bonds2

About N-methyl-N-(1-methylpiperidin-4-yl)-1H-imidazole-5-carboxamide

N-methyl-N-(1-methylpiperidin-4-yl)-1H-imidazole-5-carboxamide (PubChem CID 110475288) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is N-methyl-N-(1-methylpiperidin-4-yl)-1H-imidazole-5-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(1-methylpiperidin-4-yl)-1H-imidazole-5-carboxamide
PubChem CID110475288
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC NameN-methyl-N-(1-methylpiperidin-4-yl)-1H-imidazole-5-carboxamide
SMILESCN1CCC(N(C)C(=O)c2cnc[nH]2)CC1
InChIInChI=1S/C11H18N4O/c1-14-5-3-9(4-6-14)15(2)11(16)10-7-12-8-13-10/h7-9H,3-6H2,1-2H3,(H,12,13)
InChIKeyIGQRZCFSUZCKPA-UHFFFAOYSA-N
XLogP0.58
TPSA52.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,2-dimethyl-N-(1-methylpiperidin-4-yl)-1H-imidazole-5-carboxamide
CID 110467506
5-bromo-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide
CID 60636354
1H-imidazol-5-yl-[(3R)-3-methylpyrrolidin-1-yl]methanone
CID 89293635
N-[[(2S,5R)-5-[2-[(1,1-dioxothian-4-yl)-methylamino]-2-oxoethyl]-1-methylpyrrolidin-2-yl]methyl]-1H-imidazole-5-carboxamide
CID 171385272
5-amino-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-2-carboxamide
CID 81318919
4-[1H-imidazole-5-carbonyl(methyl)amino]oxolane-3-carboxylic acid
CID 66238171
3,5-dibromo-N-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 113349444
N-methyl-N-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine-7-carboxamide
CID 84578992
N-methyl-N-(1-methylpiperidin-4-yl)-2H-benzotriazole-5-carboxamide
CID 110468852
2-(1H-imidazol-5-yl)-2-[methyl-(1-methylpiperidin-4-yl)amino]ethanethioamide
CID 84749335
N-cyclobutyl-N-(2-hydroxyethyl)-1H-imidazole-5-carboxamide
CID 102684999
N-methyl-N-(1-methylpiperidin-4-yl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
CID 110475007

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-methylpiperidin-4-yl)-1H-imidazole-5-carboxamide?
The IUPAC name of N-methyl-N-(1-methylpiperidin-4-yl)-1H-imidazole-5-carboxamide (CID 110475288) is N-methyl-N-(1-methylpiperidin-4-yl)-1H-imidazole-5-carboxamide.
What is the SMILES notation for N-methyl-N-(1-methylpiperidin-4-yl)-1H-imidazole-5-carboxamide?
The canonical SMILES for N-methyl-N-(1-methylpiperidin-4-yl)-1H-imidazole-5-carboxamide is CN1CCC(N(C)C(=O)c2cnc[nH]2)CC1.
What is the InChIKey of N-methyl-N-(1-methylpiperidin-4-yl)-1H-imidazole-5-carboxamide?
The InChIKey is IGQRZCFSUZCKPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-14-5-3-9(4-6-14)15(2)11(16)10-7-12-8-13-10/h7-9H,3-6H2,1-2H3,(H,12,13).
What are the key properties of N-methyl-N-(1-methylpiperidin-4-yl)-1H-imidazole-5-carboxamide?
N-methyl-N-(1-methylpiperidin-4-yl)-1H-imidazole-5-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 0.58, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-methylpiperidin-4-yl)-1H-imidazole-5-carboxamide is sourced from PubChem (CID 110475288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).