5-ethyl-N,N-dimethyl-2-propyl-1H-imidazole-4-carboxamide

C11H19N3O — CID 139962300

IUPAC5-ethyl-N,N-dimethyl-2-propyl-1H-imidazole-4-carboxamide
SMILESCCCc1nc(C(=O)N(C)C)c(CC)[nH]1
InChIInChI=1S/C11H19N3O/c1-5-7-9-12-8(6-2)10(13-9)11(15)14(3)4/h5-7H2,1-4H3,(H,12,13)
InChIKeyZVRPVXWNBVXMBX-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.63
Rot. Bonds4

About 5-ethyl-N,N-dimethyl-2-propyl-1H-imidazole-4-carboxamide

5-ethyl-N,N-dimethyl-2-propyl-1H-imidazole-4-carboxamide (PubChem CID 139962300) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 5-ethyl-N,N-dimethyl-2-propyl-1H-imidazole-4-carboxamide.

Molecular Properties

Compound Name5-ethyl-N,N-dimethyl-2-propyl-1H-imidazole-4-carboxamide
PubChem CID139962300
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name5-ethyl-N,N-dimethyl-2-propyl-1H-imidazole-4-carboxamide
SMILESCCCc1nc(C(=O)N(C)C)c(CC)[nH]1
InChIInChI=1S/C11H19N3O/c1-5-7-9-12-8(6-2)10(13-9)11(15)14(3)4/h5-7H2,1-4H3,(H,12,13)
InChIKeyZVRPVXWNBVXMBX-UHFFFAOYSA-N
XLogP1.63
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-ethyl-2-propyl-1H-imidazol-4-yl)ethanone
CID 22574990
5-(hydroxymethyl)-2-propyl-1H-imidazole-4-carboxylic acid
CID 172824911
diethyl 2-propyl-1H-imidazole-4,5-dicarboxylate;hydrochloride
CID 67024452
ethyl 5-[(2S)-2-hydroxybutan-2-yl]-2-propyl-1H-imidazole-4-carboxylate
CID 86313321
6-oxo-2-propyl-1H-pyrimidine-4-carboxylic acid
CID 135741778
5-(2-methoxypropan-2-yl)-2-propyl-1H-imidazole-4-carboxylic acid
CID 67476922
3-(4,5-diethyl-1H-imidazol-2-yl)propanoic acid
CID 105449949
4-hydroxy-2-propyl-1H-imidazole-5-carboxamide
CID 12901487
2-butyl-1H-imidazole-4,5-dicarboxylic acid
CID 19036100
diethyl 2-butyl-1H-imidazole-4,5-dicarboxylate
CID 10611949
2-propyl-1H-imidazo[4,5-b]pyridine-5-carboxylic acid
CID 130705281
4-methylsulfanyl-2-propyl-1H-imidazole-5-carboxylic acid
CID 18973592

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N,N-dimethyl-2-propyl-1H-imidazole-4-carboxamide?
The IUPAC name of 5-ethyl-N,N-dimethyl-2-propyl-1H-imidazole-4-carboxamide (CID 139962300) is 5-ethyl-N,N-dimethyl-2-propyl-1H-imidazole-4-carboxamide.
What is the SMILES notation for 5-ethyl-N,N-dimethyl-2-propyl-1H-imidazole-4-carboxamide?
The canonical SMILES for 5-ethyl-N,N-dimethyl-2-propyl-1H-imidazole-4-carboxamide is CCCc1nc(C(=O)N(C)C)c(CC)[nH]1.
What is the InChIKey of 5-ethyl-N,N-dimethyl-2-propyl-1H-imidazole-4-carboxamide?
The InChIKey is ZVRPVXWNBVXMBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-5-7-9-12-8(6-2)10(13-9)11(15)14(3)4/h5-7H2,1-4H3,(H,12,13).
What are the key properties of 5-ethyl-N,N-dimethyl-2-propyl-1H-imidazole-4-carboxamide?
5-ethyl-N,N-dimethyl-2-propyl-1H-imidazole-4-carboxamide has a molecular weight of 209.29 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N,N-dimethyl-2-propyl-1H-imidazole-4-carboxamide is sourced from PubChem (CID 139962300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).