N-(2,3-dichlorophenyl)-2-propylpyrrolidine-2-carboxamide

C14H18Cl2N2O — CID 106974147

IUPACN-(2,3-dichlorophenyl)-2-propylpyrrolidine-2-carboxamide
SMILESCCCC1(C(=O)Nc2cccc(Cl)c2Cl)CCCN1
InChIInChI=1S/C14H18Cl2N2O/c1-2-7-14(8-4-9-17-14)13(19)18-11-6-3-5-10(15)12(11)16/h3,5-6,17H,2,4,7-9H2,1H3,(H,18,19)
InChIKeyDHCGVIULDMAZOG-UHFFFAOYSA-N
MW301.22 g/mol
LogP3.85
Rot. Bonds4

About N-(2,3-dichlorophenyl)-2-propylpyrrolidine-2-carboxamide

N-(2,3-dichlorophenyl)-2-propylpyrrolidine-2-carboxamide (PubChem CID 106974147) has the molecular formula C14H18Cl2N2O and a molecular weight of 301.22 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-2-propylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-2-propylpyrrolidine-2-carboxamide
PubChem CID106974147
Molecular FormulaC14H18Cl2N2O
Molecular Weight301.22 g/mol
Exact Mass300.08
IUPAC NameN-(2,3-dichlorophenyl)-2-propylpyrrolidine-2-carboxamide
SMILESCCCC1(C(=O)Nc2cccc(Cl)c2Cl)CCCN1
InChIInChI=1S/C14H18Cl2N2O/c1-2-7-14(8-4-9-17-14)13(19)18-11-6-3-5-10(15)12(11)16/h3,5-6,17H,2,4,7-9H2,1H3,(H,18,19)
InChIKeyDHCGVIULDMAZOG-UHFFFAOYSA-N
XLogP3.85
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.22
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dichlorophenyl)-3-propylpiperidine-3-carboxamide
CID 63132539
N-(2-ethylsulfanylphenyl)-2-propylpyrrolidine-2-carboxamide
CID 106974526
N-(2,6-diethylphenyl)-2-propylpyrrolidine-2-carboxamide
CID 106973997
2-propyl-N-quinolin-8-ylpyrrolidine-2-carboxamide
CID 106973994
N-(2-nitrophenyl)-2-propylpyrrolidine-2-carboxamide
CID 106974417
2-propyl-N-(2,4,6-trichlorophenyl)pyrrolidine-2-carboxamide
CID 106974176
N-(2-cyano-3-fluorophenyl)-2-propylpyrrolidine-2-carboxamide
CID 106974284
N-(3-chloro-4-methylphenyl)-2-propylpyrrolidine-2-carboxamide
CID 106973980
2-(2,6-dichlorophenyl)-1-(2-propylpyrrolidin-2-yl)ethanone
CID 106976775
(2-chlorophenyl)-(2-propylpyrrolidin-2-yl)methanone
CID 106976650
N-(2,3-dichlorophenyl)-3-ethylpiperidine-3-carboxamide
CID 55179344
N-(4-ethylphenyl)-2-propylpyrrolidine-2-carboxamide
CID 106974084

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-2-propylpyrrolidine-2-carboxamide?
The IUPAC name of N-(2,3-dichlorophenyl)-2-propylpyrrolidine-2-carboxamide (CID 106974147) is N-(2,3-dichlorophenyl)-2-propylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-2-propylpyrrolidine-2-carboxamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-2-propylpyrrolidine-2-carboxamide is CCCC1(C(=O)Nc2cccc(Cl)c2Cl)CCCN1.
What is the InChIKey of N-(2,3-dichlorophenyl)-2-propylpyrrolidine-2-carboxamide?
The InChIKey is DHCGVIULDMAZOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18Cl2N2O/c1-2-7-14(8-4-9-17-14)13(19)18-11-6-3-5-10(15)12(11)16/h3,5-6,17H,2,4,7-9H2,1H3,(H,18,19).
What are the key properties of N-(2,3-dichlorophenyl)-2-propylpyrrolidine-2-carboxamide?
N-(2,3-dichlorophenyl)-2-propylpyrrolidine-2-carboxamide has a molecular weight of 301.22 g/mol, XLogP of 3.85, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-2-propylpyrrolidine-2-carboxamide is sourced from PubChem (CID 106974147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).