N-(1H-imidazol-2-ylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide

C14H24N4O — CID 64516909

IUPACN-(1H-imidazol-2-ylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide
SMILESCCCC1(C(=O)N(C)Cc2ncc[nH]2)CCNCC1
InChIInChI=1S/C14H24N4O/c1-3-4-14(5-7-15-8-6-14)13(19)18(2)11-12-16-9-10-17-12/h9-10,15H,3-8,11H2,1-2H3,(H,16,17)
InChIKeyKGIFRGQUJOVIOF-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.54
Rot. Bonds5

About N-(1H-imidazol-2-ylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide

N-(1H-imidazol-2-ylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide (PubChem CID 64516909) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-(1H-imidazol-2-ylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(1H-imidazol-2-ylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide
PubChem CID64516909
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-(1H-imidazol-2-ylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide
SMILESCCCC1(C(=O)N(C)Cc2ncc[nH]2)CCNCC1
InChIInChI=1S/C14H24N4O/c1-3-4-14(5-7-15-8-6-14)13(19)18(2)11-12-16-9-10-17-12/h9-10,15H,3-8,11H2,1-2H3,(H,16,17)
InChIKeyKGIFRGQUJOVIOF-UHFFFAOYSA-N
XLogP1.54
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1H-imidazol-2-ylmethyl)-N,2-dimethylpiperidine-2-carboxamide
CID 113430849
1-carbamothioyl-N-(1H-imidazol-2-ylmethyl)-N-methylcyclopropane-1-carboxamide
CID 80590807
N-methyl-3-propyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyrrolidine-3-carboxamide
CID 64518648
N-(1H-imidazol-2-ylmethyl)-3-propylpyrrolidine-3-carboxamide
CID 64529966
N-(1H-imidazol-2-ylmethyl)-N-methylpiperidine-4-carboxamide
CID 64519230
N-[(4-fluorophenyl)methyl]-N-methyl-4-propylpiperidine-4-carboxamide
CID 63128063
N-(1H-imidazol-2-ylmethyl)-N-methyl-2-piperidin-4-ylacetamide
CID 64518653
N-methyl-N-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]-4-propylpiperidine-4-carboxamide
CID 64517088
N-(1H-imidazol-2-ylmethyl)-N-methylheptanamide
CID 63940803
2-chloro-N-(1H-imidazol-2-ylmethyl)-N-methylacetamide
CID 64511880
N-(1H-imidazol-2-ylmethyl)-N,2-dimethylpropanamide
CID 63929546
N-(1H-imidazol-2-ylmethyl)-N-methyl-2-[methyl(2-phenylethyl)amino]-1,3-dihydroindene-2-carboxamide
CID 56909102

Frequently Asked Questions

What is the IUPAC name of N-(1H-imidazol-2-ylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide?
The IUPAC name of N-(1H-imidazol-2-ylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide (CID 64516909) is N-(1H-imidazol-2-ylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide.
What is the SMILES notation for N-(1H-imidazol-2-ylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide?
The canonical SMILES for N-(1H-imidazol-2-ylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide is CCCC1(C(=O)N(C)Cc2ncc[nH]2)CCNCC1.
What is the InChIKey of N-(1H-imidazol-2-ylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide?
The InChIKey is KGIFRGQUJOVIOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-3-4-14(5-7-15-8-6-14)13(19)18(2)11-12-16-9-10-17-12/h9-10,15H,3-8,11H2,1-2H3,(H,16,17).
What are the key properties of N-(1H-imidazol-2-ylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide?
N-(1H-imidazol-2-ylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 1.54, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-imidazol-2-ylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide is sourced from PubChem (CID 64516909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).