1-cyclopropyl-N-(3-hydroxyphenyl)pyrrole-2-carboxamide

C14H14N2O2 — CID 43639337

IUPAC1-cyclopropyl-N-(3-hydroxyphenyl)pyrrole-2-carboxamide
SMILESO=C(Nc1cccc(O)c1)c1cccn1C1CC1
InChIInChI=1S/C14H14N2O2/c17-12-4-1-3-10(9-12)15-14(18)13-5-2-8-16(13)11-6-7-11/h1-5,8-9,11,17H,6-7H2,(H,15,18)
InChIKeyWESKPJCMELANOU-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.78
Rot. Bonds3

About 1-cyclopropyl-N-(3-hydroxyphenyl)pyrrole-2-carboxamide

1-cyclopropyl-N-(3-hydroxyphenyl)pyrrole-2-carboxamide (PubChem CID 43639337) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 1-cyclopropyl-N-(3-hydroxyphenyl)pyrrole-2-carboxamide.

Molecular Properties

Compound Name1-cyclopropyl-N-(3-hydroxyphenyl)pyrrole-2-carboxamide
PubChem CID43639337
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name1-cyclopropyl-N-(3-hydroxyphenyl)pyrrole-2-carboxamide
SMILESO=C(Nc1cccc(O)c1)c1cccn1C1CC1
InChIInChI=1S/C14H14N2O2/c17-12-4-1-3-10(9-12)15-14(18)13-5-2-8-16(13)11-6-7-11/h1-5,8-9,11,17H,6-7H2,(H,15,18)
InChIKeyWESKPJCMELANOU-UHFFFAOYSA-N
XLogP2.78
TPSA54.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(1-cyclopropylpyrrole-2-carbonyl)amino]benzoic acid
CID 43639269
N-(4-amino-3-methoxyphenyl)-1-cyclopropylpyrrole-2-carboxamide
CID 61240041
1-cyclopropyl-N-(2-hydroxy-6-nitrophenyl)pyrrole-2-carboxamide
CID 107681459
1-cyclobutyl-N-(4-iodophenyl)pyrrole-2-carboxamide
CID 114609194
N-(5-bromo-6-chloro-3-pyridinyl)-1-cyclopropylpyrrole-2-carboxamide
CID 114050566
tert-butyl 4-[2-[(3-morpholin-4-ylphenyl)carbamoyl]pyrrol-1-yl]piperidine-1-carboxylate
CID 56513587
1-cyclopropyl-N-[4-(2-hydroxycyclohexyl)oxyphenyl]pyrrole-2-carboxamide
CID 110007275
2-[2-[(1-cyclopropylpyrrole-2-carbonyl)amino]phenyl]acetic acid
CID 62535726
1-piperidin-4-yl-N-pyrimidin-5-ylpyrrole-2-carboxamide
CID 107588651
1-cyclopropyl-N-(2-hydroxyethyl)pyrrole-2-carboxamide
CID 43639342
5-[(1-cyclobutylpyrrole-2-carbonyl)amino]pyridine-2-carboxylic acid
CID 114609051
2,2-dicyclopropyl-N-(3-hydroxyphenyl)acetamide
CID 113330216

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-(3-hydroxyphenyl)pyrrole-2-carboxamide?
The IUPAC name of 1-cyclopropyl-N-(3-hydroxyphenyl)pyrrole-2-carboxamide (CID 43639337) is 1-cyclopropyl-N-(3-hydroxyphenyl)pyrrole-2-carboxamide.
What is the SMILES notation for 1-cyclopropyl-N-(3-hydroxyphenyl)pyrrole-2-carboxamide?
The canonical SMILES for 1-cyclopropyl-N-(3-hydroxyphenyl)pyrrole-2-carboxamide is O=C(Nc1cccc(O)c1)c1cccn1C1CC1.
What is the InChIKey of 1-cyclopropyl-N-(3-hydroxyphenyl)pyrrole-2-carboxamide?
The InChIKey is WESKPJCMELANOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c17-12-4-1-3-10(9-12)15-14(18)13-5-2-8-16(13)11-6-7-11/h1-5,8-9,11,17H,6-7H2,(H,15,18).
What are the key properties of 1-cyclopropyl-N-(3-hydroxyphenyl)pyrrole-2-carboxamide?
1-cyclopropyl-N-(3-hydroxyphenyl)pyrrole-2-carboxamide has a molecular weight of 242.28 g/mol, XLogP of 2.78, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-(3-hydroxyphenyl)pyrrole-2-carboxamide is sourced from PubChem (CID 43639337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).