N-[4-[(1,5-dimethylpyrrolidin-3-yl)amino]phenyl]cyclopropanecarboxamide

C16H23N3O — CID 81466509

IUPACN-[4-[(1,5-dimethylpyrrolidin-3-yl)amino]phenyl]cyclopropanecarboxamide
SMILESCC1CC(Nc2ccc(NC(=O)C3CC3)cc2)CN1C
InChIInChI=1S/C16H23N3O/c1-11-9-15(10-19(11)2)17-13-5-7-14(8-6-13)18-16(20)12-3-4-12/h5-8,11-12,15,17H,3-4,9-10H2,1-2H3,(H,18,20)
InChIKeyLSAAUARONZGPPE-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.54
Rot. Bonds4

About N-[4-[(1,5-dimethylpyrrolidin-3-yl)amino]phenyl]cyclopropanecarboxamide

N-[4-[(1,5-dimethylpyrrolidin-3-yl)amino]phenyl]cyclopropanecarboxamide (PubChem CID 81466509) has the molecular formula C16H23N3O and a molecular weight of 273.38 g/mol. Its IUPAC name is N-[4-[(1,5-dimethylpyrrolidin-3-yl)amino]phenyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[4-[(1,5-dimethylpyrrolidin-3-yl)amino]phenyl]cyclopropanecarboxamide
PubChem CID81466509
Molecular FormulaC16H23N3O
Molecular Weight273.38 g/mol
Exact Mass273.18
IUPAC NameN-[4-[(1,5-dimethylpyrrolidin-3-yl)amino]phenyl]cyclopropanecarboxamide
SMILESCC1CC(Nc2ccc(NC(=O)C3CC3)cc2)CN1C
InChIInChI=1S/C16H23N3O/c1-11-9-15(10-19(11)2)17-13-5-7-14(8-6-13)18-16(20)12-3-4-12/h5-8,11-12,15,17H,3-4,9-10H2,1-2H3,(H,18,20)
InChIKeyLSAAUARONZGPPE-UHFFFAOYSA-N
XLogP2.54
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[4-[(1,5-dimethylpyrrolidin-3-yl)amino]phenyl]cyclopropanecarboxamide 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-[4-[(3-methylcyclobutyl)amino]phenyl]cyclopropanecarboxamide
CID 104860025
4-[(1,5-dimethylpyrrolidin-3-yl)amino]benzoic acid
CID 81466326
N-[4-[(4-methylcyclohexyl)amino]phenyl]cyclopropanecarboxamide
CID 28660300
N-[4-(cyclooctylamino)phenyl]cyclopropanecarboxamide
CID 29049901
N-(4-methoxyphenyl)-1,5-dimethylpyrrolidin-3-amine
CID 81466424
1-N-(1,5-dimethylpyrrolidin-3-yl)-4-N,4-N-diethylbenzene-1,4-diamine
CID 81465612
[3-[(1,5-dimethylpyrrolidin-3-yl)amino]phenyl]urea
CID 81466059
N-[4-[(1,1-dioxothian-4-yl)amino]phenyl]cyclopropanecarboxamide
CID 43511624
N-[4-(cycloheptylamino)phenyl]cyclobutanecarboxamide
CID 112985012
(2R)-N-[4-[[(3S,5R)-1-cyclopropyl-5-methylpyrrolidin-3-yl]amino]phenyl]oxolane-2-carboxamide
CID 98874802
1,5-dimethyl-N-(4-propoxyphenyl)pyrrolidin-3-amine
CID 81466938
N-[4-(cyclopropanecarbonylamino)phenyl]cyclohexanecarboxamide
CID 25276011

Frequently Asked Questions

What is the IUPAC name of N-[4-[(1,5-dimethylpyrrolidin-3-yl)amino]phenyl]cyclopropanecarboxamide?
The IUPAC name of N-[4-[(1,5-dimethylpyrrolidin-3-yl)amino]phenyl]cyclopropanecarboxamide (CID 81466509) is N-[4-[(1,5-dimethylpyrrolidin-3-yl)amino]phenyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[4-[(1,5-dimethylpyrrolidin-3-yl)amino]phenyl]cyclopropanecarboxamide?
The canonical SMILES for N-[4-[(1,5-dimethylpyrrolidin-3-yl)amino]phenyl]cyclopropanecarboxamide is CC1CC(Nc2ccc(NC(=O)C3CC3)cc2)CN1C.
What is the InChIKey of N-[4-[(1,5-dimethylpyrrolidin-3-yl)amino]phenyl]cyclopropanecarboxamide?
The InChIKey is LSAAUARONZGPPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O/c1-11-9-15(10-19(11)2)17-13-5-7-14(8-6-13)18-16(20)12-3-4-12/h5-8,11-12,15,17H,3-4,9-10H2,1-2H3,(H,18,20).
What are the key properties of N-[4-[(1,5-dimethylpyrrolidin-3-yl)amino]phenyl]cyclopropanecarboxamide?
N-[4-[(1,5-dimethylpyrrolidin-3-yl)amino]phenyl]cyclopropanecarboxamide has a molecular weight of 273.38 g/mol, XLogP of 2.54, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(1,5-dimethylpyrrolidin-3-yl)amino]phenyl]cyclopropanecarboxamide is sourced from PubChem (CID 81466509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).