N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide

C15H15FN2O — CID 110481000

IUPACN-[[1-(2-fluorophenyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide
SMILESO=C(NCC1(c2ccccc2F)CC1)c1ccc[nH]1
InChIInChI=1S/C15H15FN2O/c16-12-5-2-1-4-11(12)15(7-8-15)10-18-14(19)13-6-3-9-17-13/h1-6,9,17H,7-8,10H2,(H,18,19)
InChIKeyUTQYTIFYXJFCRB-UHFFFAOYSA-N
MW258.30 g/mol
LogP2.62
Rot. Bonds4

About N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide

N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide (PubChem CID 110481000) has the molecular formula C15H15FN2O and a molecular weight of 258.30 g/mol. Its IUPAC name is N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide.

Molecular Properties

Compound NameN-[[1-(2-fluorophenyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide
PubChem CID110481000
Molecular FormulaC15H15FN2O
Molecular Weight258.30 g/mol
Exact Mass258.12
IUPAC NameN-[[1-(2-fluorophenyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide
SMILESO=C(NCC1(c2ccccc2F)CC1)c1ccc[nH]1
InChIInChI=1S/C15H15FN2O/c16-12-5-2-1-4-11(12)15(7-8-15)10-18-14(19)13-6-3-9-17-13/h1-6,9,17H,7-8,10H2,(H,18,19)
InChIKeyUTQYTIFYXJFCRB-UHFFFAOYSA-N
XLogP2.62
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.30
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[1-(2-fluorophenyl)cyclopropyl]methyl]pyridine-2-carboxamide
CID 110481986
1-[[1-(2-fluorophenyl)cyclopropyl]methyl]-3-methoxyurea
CID 56806394
4-[[1-(2-fluorophenyl)cyclopropyl]methylamino]-4-oxobutanoic acid
CID 110481809
2-amino-N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide
CID 110480076
N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-4-(hydroxymethyl)-4-methylpiperidine-1-carboxamide
CID 86792113
(2E,4E)-N-[[1-(2-fluorophenyl)cyclopropyl]methyl]hexa-2,4-dienamide
CID 110481161
1-[[1-(2-fluorophenyl)cyclopropyl]methyl]-3-[[(3R)-3-hydroxythiolan-3-yl]methyl]urea
CID 97079912
N-[[1-(2-fluorophenyl)cyclopropyl]methyl]formamide
CID 110477207
1-[[1-(2-fluorophenyl)cyclopropyl]methyl]-2,3-dimethylguanidine
CID 86777752
2-[1-(2-fluorophenyl)cyclopropyl]acetic acid
CID 82075914
1-[1-(2-fluorophenyl)cyclopropyl]-3-(1H-pyrrol-2-ylmethyl)urea
CID 110469652
N-(2-fluorophenyl)-1H-pyrrole-2-carboxamide
CID 51210810

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide?
The IUPAC name of N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide (CID 110481000) is N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide.
What is the SMILES notation for N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide?
The canonical SMILES for N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide is O=C(NCC1(c2ccccc2F)CC1)c1ccc[nH]1.
What is the InChIKey of N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide?
The InChIKey is UTQYTIFYXJFCRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O/c16-12-5-2-1-4-11(12)15(7-8-15)10-18-14(19)13-6-3-9-17-13/h1-6,9,17H,7-8,10H2,(H,18,19).
What are the key properties of N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide?
N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide has a molecular weight of 258.30 g/mol, XLogP of 2.62, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide is sourced from PubChem (CID 110481000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).