3-methyl-N-(2-propylphenyl)pyrrolidine-2-carboxamide

C15H22N2O — CID 102777801

IUPAC3-methyl-N-(2-propylphenyl)pyrrolidine-2-carboxamide
SMILESCCCc1ccccc1NC(=O)C1NCCC1C
InChIInChI=1S/C15H22N2O/c1-3-6-12-7-4-5-8-13(12)17-15(18)14-11(2)9-10-16-14/h4-5,7-8,11,14,16H,3,6,9-10H2,1-2H3,(H,17,18)
InChIKeyBCKPBGIQOLNHFY-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.58
Rot. Bonds4

About 3-methyl-N-(2-propylphenyl)pyrrolidine-2-carboxamide

3-methyl-N-(2-propylphenyl)pyrrolidine-2-carboxamide (PubChem CID 102777801) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 3-methyl-N-(2-propylphenyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(2-propylphenyl)pyrrolidine-2-carboxamide
PubChem CID102777801
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name3-methyl-N-(2-propylphenyl)pyrrolidine-2-carboxamide
SMILESCCCc1ccccc1NC(=O)C1NCCC1C
InChIInChI=1S/C15H22N2O/c1-3-6-12-7-4-5-8-13(12)17-15(18)14-11(2)9-10-16-14/h4-5,7-8,11,14,16H,3,6,9-10H2,1-2H3,(H,17,18)
InChIKeyBCKPBGIQOLNHFY-UHFFFAOYSA-N
XLogP2.58
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-N-[2-(pyrrolidin-1-ylmethyl)phenyl]pyrrolidine-2-carboxamide
CID 102778235
N-(2-methoxyphenyl)-3-methylpyrrolidine-2-carboxamide
CID 102776806
N-[2-(dimethylamino)phenyl]-3-methylpyrrolidine-2-carboxamide
CID 102778094
N-(2-propylphenyl)-1,3-thiazolidine-4-carboxamide
CID 43703955
3-methyl-N-(4-methyl-2-propoxyphenyl)pyrrolidine-2-carboxamide
CID 102778369
2-amino-N-(2-propylphenyl)cyclopropane-1-carboxamide
CID 82239256
2-chloro-6-[(3-methylpyrrolidine-2-carbonyl)amino]benzoic acid
CID 102779465
3-methyl-N-[4-(propanoylamino)phenyl]pyrrolidine-2-carboxamide
CID 102778022
3-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide
CID 102780018
ethyl 2-[(3-methylpiperidine-2-carbonyl)amino]benzoate
CID 107067999
ethane;N-(2-propylphenyl)acetamide
CID 142804217
N-(2,6-dichlorophenyl)-3-methylpyrrolidine-2-carboxamide
CID 102779613

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2-propylphenyl)pyrrolidine-2-carboxamide?
The IUPAC name of 3-methyl-N-(2-propylphenyl)pyrrolidine-2-carboxamide (CID 102777801) is 3-methyl-N-(2-propylphenyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 3-methyl-N-(2-propylphenyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 3-methyl-N-(2-propylphenyl)pyrrolidine-2-carboxamide is CCCc1ccccc1NC(=O)C1NCCC1C.
What is the InChIKey of 3-methyl-N-(2-propylphenyl)pyrrolidine-2-carboxamide?
The InChIKey is BCKPBGIQOLNHFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-3-6-12-7-4-5-8-13(12)17-15(18)14-11(2)9-10-16-14/h4-5,7-8,11,14,16H,3,6,9-10H2,1-2H3,(H,17,18).
What are the key properties of 3-methyl-N-(2-propylphenyl)pyrrolidine-2-carboxamide?
3-methyl-N-(2-propylphenyl)pyrrolidine-2-carboxamide has a molecular weight of 246.35 g/mol, XLogP of 2.58, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2-propylphenyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 102777801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).