1-(furan-2-ylmethyl)-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide

C16H22N4O2 — CID 155874103

IUPAC1-(furan-2-ylmethyl)-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide
SMILESCN(C)C(=O)C1(n2ccnc2)CCN(Cc2ccco2)CC1
InChIInChI=1S/C16H22N4O2/c1-18(2)15(21)16(20-10-7-17-13-20)5-8-19(9-6-16)12-14-4-3-11-22-14/h3-4,7,10-11,13H,5-6,8-9,12H2,1-2H3
InChIKeyGDAGYACEPMIZRJ-UHFFFAOYSA-N
MW302.38 g/mol
LogP1.56
Rot. Bonds4

About 1-(furan-2-ylmethyl)-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide

1-(furan-2-ylmethyl)-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide (PubChem CID 155874103) has the molecular formula C16H22N4O2 and a molecular weight of 302.38 g/mol. Its IUPAC name is 1-(furan-2-ylmethyl)-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(furan-2-ylmethyl)-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide
PubChem CID155874103
Molecular FormulaC16H22N4O2
Molecular Weight302.38 g/mol
Exact Mass302.17
IUPAC Name1-(furan-2-ylmethyl)-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide
SMILESCN(C)C(=O)C1(n2ccnc2)CCN(Cc2ccco2)CC1
InChIInChI=1S/C16H22N4O2/c1-18(2)15(21)16(20-10-7-17-13-20)5-8-19(9-6-16)12-14-4-3-11-22-14/h3-4,7,10-11,13H,5-6,8-9,12H2,1-2H3
InChIKeyGDAGYACEPMIZRJ-UHFFFAOYSA-N
XLogP1.56
TPSA54.51 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-imidazol-1-yl-N,N-dimethyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-4-carboxamide
CID 155871375
1-[(2-chlorophenyl)methyl]-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide;formic acid
CID 171695756
1-(2-ethylbutyl)-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide
CID 155872498
N-(furan-2-ylmethyl)-4-imidazol-1-yl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidine-4-carboxamide
CID 155873982
4-(dimethylamino)-1-(furan-2-ylmethyl)piperidine-4-carboxylic acid
CID 117011999
[4-(furan-2-ylmethyl)piperazin-1-yl]-imidazol-1-ylmethanone
CID 112723540
2-[(4R)-1'-(furan-2-ylmethyl)spiro[3,4-dihydrochromene-2,4'-piperidine]-4-yl]-N,N-dimethylacetamide
CID 97376261
1-[(2-ethoxyphenyl)methyl]-4-imidazol-1-ylpiperidine-4-carboxylic acid
CID 56889081
(3S)-1-(furan-2-ylmethyl)-N-[[1-(imidazol-1-ylmethyl)cyclopropyl]methyl]piperidine-3-carboxamide
CID 95046843
[4-amino-1-(furan-2-ylmethyl)piperidin-4-yl]methanol
CID 117012092
3-[9-(furan-2-ylmethyl)-1-oxa-9-azaspiro[5.5]undecan-4-yl]-1,1-dimethylurea
CID 131648359
1-(furan-2-ylmethyl)-N,N-dimethylpiperidin-4-amine
CID 91664788

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-ylmethyl)-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide?
The IUPAC name of 1-(furan-2-ylmethyl)-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide (CID 155874103) is 1-(furan-2-ylmethyl)-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(furan-2-ylmethyl)-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide?
The canonical SMILES for 1-(furan-2-ylmethyl)-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide is CN(C)C(=O)C1(n2ccnc2)CCN(Cc2ccco2)CC1.
What is the InChIKey of 1-(furan-2-ylmethyl)-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide?
The InChIKey is GDAGYACEPMIZRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O2/c1-18(2)15(21)16(20-10-7-17-13-20)5-8-19(9-6-16)12-14-4-3-11-22-14/h3-4,7,10-11,13H,5-6,8-9,12H2,1-2H3.
What are the key properties of 1-(furan-2-ylmethyl)-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide?
1-(furan-2-ylmethyl)-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide has a molecular weight of 302.38 g/mol, XLogP of 1.56, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-ylmethyl)-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide is sourced from PubChem (CID 155874103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).