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

C14H28N2O — CID 106975317

IUPACN-(2,3-dimethylbutyl)-2-propylpyrrolidine-2-carboxamide
SMILESCCCC1(C(=O)NCC(C)C(C)C)CCCN1
InChIInChI=1S/C14H28N2O/c1-5-7-14(8-6-9-16-14)13(17)15-10-12(4)11(2)3/h11-12,16H,5-10H2,1-4H3,(H,15,17)
InChIKeyJLYCJBWHTJFRHV-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.32
Rot. Bonds6

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

N-(2,3-dimethylbutyl)-2-propylpyrrolidine-2-carboxamide (PubChem CID 106975317) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-(2,3-dimethylbutyl)-2-propylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(2,3-dimethylbutyl)-2-propylpyrrolidine-2-carboxamide
PubChem CID106975317
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-(2,3-dimethylbutyl)-2-propylpyrrolidine-2-carboxamide
SMILESCCCC1(C(=O)NCC(C)C(C)C)CCCN1
InChIInChI=1S/C14H28N2O/c1-5-7-14(8-6-9-16-14)13(17)15-10-12(4)11(2)3/h11-12,16H,5-10H2,1-4H3,(H,15,17)
InChIKeyJLYCJBWHTJFRHV-UHFFFAOYSA-N
XLogP2.32
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,2-dimethoxyethyl)-2-propylpyrrolidine-2-carboxamide
CID 106974916
N-(2-phenylpropyl)-2-propylpyrrolidine-2-carboxamide
CID 106974945
N-(2-hydroxy-2-phenylethyl)-2-propylpyrrolidine-2-carboxamide
CID 106974225
N-octyl-2-propylpyrrolidine-2-carboxamide
CID 106975640
N-(2-oxo-2-piperidin-1-ylethyl)-2-propylpyrrolidine-2-carboxamide
CID 106975739
N-[(1-hydroxycycloheptyl)methyl]-2-propylpyrrolidine-2-carboxamide
CID 106975355
N-(4-propan-2-yloxybutyl)-2-propylpyrrolidine-2-carboxamide
CID 106011154
1-[(2-propylpyrrolidine-2-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 106974817
3-[(2-ethylpyrrolidine-2-carbonyl)amino]-2-methylpropanoic acid
CID 83071374
(2S)-3,3-dimethyl-2-[(2-propylpyrrolidine-2-carbonyl)amino]butanoic acid
CID 106974844
N-(4-methylsulfanylbutyl)-2-propylpyrrolidine-2-carboxamide
CID 106975806
N-[(4-fluorophenyl)methyl]-2-propylpyrrolidine-2-carboxamide
CID 106974072

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylbutyl)-2-propylpyrrolidine-2-carboxamide?
The IUPAC name of N-(2,3-dimethylbutyl)-2-propylpyrrolidine-2-carboxamide (CID 106975317) is N-(2,3-dimethylbutyl)-2-propylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-(2,3-dimethylbutyl)-2-propylpyrrolidine-2-carboxamide?
The canonical SMILES for N-(2,3-dimethylbutyl)-2-propylpyrrolidine-2-carboxamide is CCCC1(C(=O)NCC(C)C(C)C)CCCN1.
What is the InChIKey of N-(2,3-dimethylbutyl)-2-propylpyrrolidine-2-carboxamide?
The InChIKey is JLYCJBWHTJFRHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-5-7-14(8-6-9-16-14)13(17)15-10-12(4)11(2)3/h11-12,16H,5-10H2,1-4H3,(H,15,17).
What are the key properties of N-(2,3-dimethylbutyl)-2-propylpyrrolidine-2-carboxamide?
N-(2,3-dimethylbutyl)-2-propylpyrrolidine-2-carboxamide has a molecular weight of 240.39 g/mol, XLogP of 2.32, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylbutyl)-2-propylpyrrolidine-2-carboxamide is sourced from PubChem (CID 106975317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).