N-pyrrol-1-ylpropanamide

C7H10N2O — CID 57293294

IUPACN-pyrrol-1-ylpropanamide
SMILESCCC(=O)Nn1cccc1
InChIInChI=1S/C7H10N2O/c1-2-7(10)8-9-5-3-4-6-9/h3-6H,2H2,1H3,(H,8,10)
InChIKeyZJYAWEHLTYFSBS-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.97
Rot. Bonds2

About N-pyrrol-1-ylpropanamide

N-pyrrol-1-ylpropanamide (PubChem CID 57293294) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is N-pyrrol-1-ylpropanamide.

Molecular Properties

Compound NameN-pyrrol-1-ylpropanamide
PubChem CID57293294
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC NameN-pyrrol-1-ylpropanamide
SMILESCCC(=O)Nn1cccc1
InChIInChI=1S/C7H10N2O/c1-2-7(10)8-9-5-3-4-6-9/h3-6H,2H2,1H3,(H,8,10)
InChIKeyZJYAWEHLTYFSBS-UHFFFAOYSA-N
XLogP0.97
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-pyrrol-1-ylpropanamide 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

1-(Dimethylamino)pyrrole
CID 573527
tert-Butyl 1H-pyrrol-1-ylcarbamate
CID 49760548
N-methyl-1H-pyrrol-1-amine
CID 14232103
methyl N-(3-fluoropyrrol-1-yl)carbamate
CID 177851270
N-pyrrol-1-ylformamide
CID 56980626
N-ureidopyrrole
CID 66968528
2,2-difluoro-N-pyrrol-1-ylacetamide
CID 130778264
N-(2-azetidinonyl) pyrrol
CID 138857984
N-(3,3,3-trifluoropropyl)pyrrol-1-amine
CID 79101147
2-(pyrrol-1-ylamino)-N-(2,2,2-trifluoroethyl)acetamide
CID 79101260
N-(2,2-difluoroethyl)pyrrol-1-amine
CID 79101448
N-pyrrol-1-yl-2-(2,2,2-trifluoroethylamino)acetamide
CID 79260501

Frequently Asked Questions

What is the IUPAC name of N-pyrrol-1-ylpropanamide?
The IUPAC name of N-pyrrol-1-ylpropanamide (CID 57293294) is N-pyrrol-1-ylpropanamide.
What is the SMILES notation for N-pyrrol-1-ylpropanamide?
The canonical SMILES for N-pyrrol-1-ylpropanamide is CCC(=O)Nn1cccc1.
What is the InChIKey of N-pyrrol-1-ylpropanamide?
The InChIKey is ZJYAWEHLTYFSBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-2-7(10)8-9-5-3-4-6-9/h3-6H,2H2,1H3,(H,8,10).
What are the key properties of N-pyrrol-1-ylpropanamide?
N-pyrrol-1-ylpropanamide has a molecular weight of 138.17 g/mol, XLogP of 0.97, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyrrol-1-ylpropanamide is sourced from PubChem (CID 57293294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).