N-(1H-imidazol-2-yl)-1-propylpyrrole-2-carboxamide

C11H14N4O — CID 63564838

IUPACN-(1H-imidazol-2-yl)-1-propylpyrrole-2-carboxamide
SMILESCCCn1cccc1C(=O)Nc1ncc[nH]1
InChIInChI=1S/C11H14N4O/c1-2-7-15-8-3-4-9(15)10(16)14-11-12-5-6-13-11/h3-6,8H,2,7H2,1H3,(H2,12,13,14,16)
InChIKeyFTJOMFWNRLDYSQ-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.87
Rot. Bonds4

About N-(1H-imidazol-2-yl)-1-propylpyrrole-2-carboxamide

N-(1H-imidazol-2-yl)-1-propylpyrrole-2-carboxamide (PubChem CID 63564838) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is N-(1H-imidazol-2-yl)-1-propylpyrrole-2-carboxamide.

Molecular Properties

Compound NameN-(1H-imidazol-2-yl)-1-propylpyrrole-2-carboxamide
PubChem CID63564838
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC NameN-(1H-imidazol-2-yl)-1-propylpyrrole-2-carboxamide
SMILESCCCn1cccc1C(=O)Nc1ncc[nH]1
InChIInChI=1S/C11H14N4O/c1-2-7-15-8-3-4-9(15)10(16)14-11-12-5-6-13-11/h3-6,8H,2,7H2,1H3,(H2,12,13,14,16)
InChIKeyFTJOMFWNRLDYSQ-UHFFFAOYSA-N
XLogP1.87
TPSA62.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-bromo-N-(1H-imidazol-2-yl)-1-propylpyrrole-2-carboxamide
CID 63565030
1-propyl-N-(1H-pyrazol-5-yl)pyrrole-2-carboxamide
CID 61394373
3-[(1-propylpyrrole-2-carbonyl)amino]pyrazine-2-carboxylic acid
CID 63262330
N-(4-bromophenyl)-1-propylpyrrole-2-carboxamide
CID 43639066
N-(1H-imidazol-2-yl)-2-methylbenzamide
CID 60968635
2-hydroxy-N-(1H-imidazol-2-yl)-3-methylbenzamide
CID 60968361
N-(1H-imidazol-2-yl)-4-pyrazol-1-ylbenzamide
CID 60968230
N-(2,3-dihydroxypropyl)-1-propylpyrrole-2-carboxamide
CID 66176682
4-chloro-N-(1H-imidazol-2-yl)-1-methylpyrrole-2-carboxamide
CID 60968792
N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]-1-propylpyrrole-2-carboxamide
CID 114010730
N-(1H-imidazol-2-yl)-1-methyl-2-oxopyridine-4-carboxamide
CID 60966951
4-butoxy-N-(1H-imidazol-2-yl)benzamide
CID 60968641

Frequently Asked Questions

What is the IUPAC name of N-(1H-imidazol-2-yl)-1-propylpyrrole-2-carboxamide?
The IUPAC name of N-(1H-imidazol-2-yl)-1-propylpyrrole-2-carboxamide (CID 63564838) is N-(1H-imidazol-2-yl)-1-propylpyrrole-2-carboxamide.
What is the SMILES notation for N-(1H-imidazol-2-yl)-1-propylpyrrole-2-carboxamide?
The canonical SMILES for N-(1H-imidazol-2-yl)-1-propylpyrrole-2-carboxamide is CCCn1cccc1C(=O)Nc1ncc[nH]1.
What is the InChIKey of N-(1H-imidazol-2-yl)-1-propylpyrrole-2-carboxamide?
The InChIKey is FTJOMFWNRLDYSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-2-7-15-8-3-4-9(15)10(16)14-11-12-5-6-13-11/h3-6,8H,2,7H2,1H3,(H2,12,13,14,16).
What are the key properties of N-(1H-imidazol-2-yl)-1-propylpyrrole-2-carboxamide?
N-(1H-imidazol-2-yl)-1-propylpyrrole-2-carboxamide has a molecular weight of 218.26 g/mol, XLogP of 1.87, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-imidazol-2-yl)-1-propylpyrrole-2-carboxamide is sourced from PubChem (CID 63564838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).