1-[(3,5-dimethoxyphenyl)methyl]-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide

C20H28N4O3 — CID 155877437

IUPAC1-[(3,5-dimethoxyphenyl)methyl]-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide
SMILESCOc1cc(CN2CCC(C(=O)N(C)C)(n3ccnc3)CC2)cc(OC)c1
InChIInChI=1S/C20H28N4O3/c1-22(2)19(25)20(24-10-7-21-15-24)5-8-23(9-6-20)14-16-11-17(26-3)13-18(12-16)27-4/h7,10-13,15H,5-6,8-9,14H2,1-4H3
InChIKeyHCXIJFBRBVQAHP-UHFFFAOYSA-N
MW372.47 g/mol
LogP1.98
Rot. Bonds6

About 1-[(3,5-dimethoxyphenyl)methyl]-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide

1-[(3,5-dimethoxyphenyl)methyl]-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide (PubChem CID 155877437) has the molecular formula C20H28N4O3 and a molecular weight of 372.47 g/mol. Its IUPAC name is 1-[(3,5-dimethoxyphenyl)methyl]-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-[(3,5-dimethoxyphenyl)methyl]-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide
PubChem CID155877437
Molecular FormulaC20H28N4O3
Molecular Weight372.47 g/mol
Exact Mass372.22
IUPAC Name1-[(3,5-dimethoxyphenyl)methyl]-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide
SMILESCOc1cc(CN2CCC(C(=O)N(C)C)(n3ccnc3)CC2)cc(OC)c1
InChIInChI=1S/C20H28N4O3/c1-22(2)19(25)20(24-10-7-21-15-24)5-8-23(9-6-20)14-16-11-17(26-3)13-18(12-16)27-4/h7,10-13,15H,5-6,8-9,14H2,1-4H3
InChIKeyHCXIJFBRBVQAHP-UHFFFAOYSA-N
XLogP1.98
TPSA59.83 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-(2-ethylbutyl)-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide
CID 155872498
1-(furan-2-ylmethyl)-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide
CID 155874103
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
3-[(3,5-dimethoxyphenyl)methyl]-1-[1-[(3,5-dimethoxyphenyl)methyl]-4-formylpiperidin-4-yl]-1-methylurea
CID 89103114
4-imidazol-1-yl-1-[[4-methoxy-3-(methoxymethyl)phenyl]methyl]piperidine-4-carboxylic acid
CID 56898257
4-imidazol-1-yl-N,N-dimethyl-1-propylsulfonylpiperidine-4-carboxamide
CID 155876535
1-[(3-chloro-5-fluorophenyl)methyl]-4-imidazol-1-ylpiperidine-4-carboxylic acid
CID 56894489
4-imidazol-1-yl-N-(2-methoxyethyl)-1-[(4-methylphenyl)methyl]piperidine-4-carboxamide
CID 155871591
formic acid;4-imidazol-1-yl-N-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)piperidine-4-carboxamide
CID 155875558
formic acid;4-imidazol-1-yl-N-(2-methoxyethyl)-1-(pyridin-3-ylmethyl)piperidine-4-carboxamide
CID 171695932
4-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide
CID 155873379

Frequently Asked Questions

What is the IUPAC name of 1-[(3,5-dimethoxyphenyl)methyl]-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide?
The IUPAC name of 1-[(3,5-dimethoxyphenyl)methyl]-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide (CID 155877437) is 1-[(3,5-dimethoxyphenyl)methyl]-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide.
What is the SMILES notation for 1-[(3,5-dimethoxyphenyl)methyl]-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide?
The canonical SMILES for 1-[(3,5-dimethoxyphenyl)methyl]-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide is COc1cc(CN2CCC(C(=O)N(C)C)(n3ccnc3)CC2)cc(OC)c1.
What is the InChIKey of 1-[(3,5-dimethoxyphenyl)methyl]-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide?
The InChIKey is HCXIJFBRBVQAHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4O3/c1-22(2)19(25)20(24-10-7-21-15-24)5-8-23(9-6-20)14-16-11-17(26-3)13-18(12-16)27-4/h7,10-13,15H,5-6,8-9,14H2,1-4H3.
What are the key properties of 1-[(3,5-dimethoxyphenyl)methyl]-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide?
1-[(3,5-dimethoxyphenyl)methyl]-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide has a molecular weight of 372.47 g/mol, XLogP of 1.98, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3,5-dimethoxyphenyl)methyl]-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide is sourced from PubChem (CID 155877437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).