N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]pyrrolidine-3-carboxamide;hydrochloride

C15H19Cl3N2O — CID 119740768

IUPACN-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]pyrrolidine-3-carboxamide;hydrochloride
SMILESCl.O=C(C1CCNC1)N(Cc1ccc(Cl)c(Cl)c1)C1CC1
InChIInChI=1S/C15H18Cl2N2O.ClH/c16-13-4-1-10(7-14(13)17)9-19(12-2-3-12)15(20)11-5-6-18-8-11;/h1,4,7,11-12,18H,2-3,5-6,8-9H2;1H
InChIKeyFKEXMLFLBLQJRA-UHFFFAOYSA-N
MW349.69 g/mol
LogP3.52
Rot. Bonds4

About N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]pyrrolidine-3-carboxamide;hydrochloride

N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]pyrrolidine-3-carboxamide;hydrochloride (PubChem CID 119740768) has the molecular formula C15H19Cl3N2O and a molecular weight of 349.69 g/mol. Its IUPAC name is N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]pyrrolidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]pyrrolidine-3-carboxamide;hydrochloride
PubChem CID119740768
Molecular FormulaC15H19Cl3N2O
Molecular Weight349.69 g/mol
Exact Mass348.06
IUPAC NameN-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]pyrrolidine-3-carboxamide;hydrochloride
SMILESCl.O=C(C1CCNC1)N(Cc1ccc(Cl)c(Cl)c1)C1CC1
InChIInChI=1S/C15H18Cl2N2O.ClH/c16-13-4-1-10(7-14(13)17)9-19(12-2-3-12)15(20)11-5-6-18-8-11;/h1,4,7,11-12,18H,2-3,5-6,8-9H2;1H
InChIKeyFKEXMLFLBLQJRA-UHFFFAOYSA-N
XLogP3.52
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.69
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]pyrrolidine-3-carboxamide;hydrochloride 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-[(3,4-dichlorophenyl)methyl]-N-ethylpyrrolidine-3-carboxamide
CID 119743617
N-cyclopropyl-N-[(4-methylphenyl)methyl]pyrrolidine-3-carboxamide
CID 55149693
N-cyclopropyl-N-(thiophen-3-ylmethyl)pyrrolidine-3-carboxamide
CID 63006718
N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-2-piperidin-4-ylacetamide
CID 119740757
N-[(3,4-dichlorophenyl)methyl]-N-propan-2-ylpiperidine-3-carboxamide;hydrochloride
CID 119298606
N-cyclopropyl-N-[(4-fluorophenyl)methyl]piperidine-3-carboxamide
CID 60937275
N-[(3-bromophenyl)methyl]-N-cyclopropylpiperidine-3-carboxamide;hydrochloride
CID 119284886
N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]propanamide
CID 61061495
(3S)-N-cyclopropyl-N-[(3-fluorophenyl)methyl]piperidine-3-carboxamide
CID 81128664
N-cyclopentyl-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperidine-3-carboxamide;hydrochloride
CID 119318107
N-cyclopropyl-N-[(3-fluorophenyl)methyl]piperidine-4-carboxamide;hydrochloride
CID 119284923
(3'S)-N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-5,6-difluorospiro[1H-2-benzofuran-3,4'-piperidine]-3'-carboxamide
CID 51037696

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]pyrrolidine-3-carboxamide;hydrochloride?
The IUPAC name of N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]pyrrolidine-3-carboxamide;hydrochloride (CID 119740768) is N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]pyrrolidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]pyrrolidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]pyrrolidine-3-carboxamide;hydrochloride is Cl.O=C(C1CCNC1)N(Cc1ccc(Cl)c(Cl)c1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]pyrrolidine-3-carboxamide;hydrochloride?
The InChIKey is FKEXMLFLBLQJRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18Cl2N2O.ClH/c16-13-4-1-10(7-14(13)17)9-19(12-2-3-12)15(20)11-5-6-18-8-11;/h1,4,7,11-12,18H,2-3,5-6,8-9H2;1H.
What are the key properties of N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]pyrrolidine-3-carboxamide;hydrochloride?
N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]pyrrolidine-3-carboxamide;hydrochloride has a molecular weight of 349.69 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]pyrrolidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119740768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).