N-methyl-N-(2-phenylpropyl)pyrrolidine-2-carboxamide;hydrochloride

C15H23ClN2O — CID 119316587

IUPACN-methyl-N-(2-phenylpropyl)pyrrolidine-2-carboxamide;hydrochloride
SMILESCC(CN(C)C(=O)C1CCCN1)c1ccccc1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-12(13-7-4-3-5-8-13)11-17(2)15(18)14-9-6-10-16-14;/h3-5,7-8,12,14,16H,6,9-11H2,1-2H3;1H
InChIKeyHRTBGIUYFOEUIB-UHFFFAOYSA-N
MW282.81 g/mol
LogP2.42
Rot. Bonds4

About N-methyl-N-(2-phenylpropyl)pyrrolidine-2-carboxamide;hydrochloride

N-methyl-N-(2-phenylpropyl)pyrrolidine-2-carboxamide;hydrochloride (PubChem CID 119316587) has the molecular formula C15H23ClN2O and a molecular weight of 282.81 g/mol. Its IUPAC name is N-methyl-N-(2-phenylpropyl)pyrrolidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-methyl-N-(2-phenylpropyl)pyrrolidine-2-carboxamide;hydrochloride
PubChem CID119316587
Molecular FormulaC15H23ClN2O
Molecular Weight282.81 g/mol
Exact Mass282.15
IUPAC NameN-methyl-N-(2-phenylpropyl)pyrrolidine-2-carboxamide;hydrochloride
SMILESCC(CN(C)C(=O)C1CCCN1)c1ccccc1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-12(13-7-4-3-5-8-13)11-17(2)15(18)14-9-6-10-16-14;/h3-5,7-8,12,14,16H,6,9-11H2,1-2H3;1H
InChIKeyHRTBGIUYFOEUIB-UHFFFAOYSA-N
XLogP2.42
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.81
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-benzyl-N-methylpyrrolidine-2-carboxamide
CID 22691346
N-[2-(benzylamino)-2-oxoethyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride
CID 119331213
N-methyl-N-phenylpyrrolidine-2-carboxamide
CID 550989
N-[(2-chlorophenyl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride
CID 119267609
(2S)-N-(2-anilino-2-oxoethyl)-N-methylpyrrolidine-2-carboxamide
CID 61165460
(2S)-N-methyl-N-(2-phenoxyethyl)pyrrolidine-2-carboxamide
CID 61164431
(2R)-N-[[1-[(2S)-2-hydroxy-2-phenylethyl]piperidin-4-yl]methyl]-N-methylpyrrolidine-2-carboxamide
CID 99820905
(2R)-N-methyl-N-[(2-methylphenyl)methyl]pyrrolidine-2-carboxamide
CID 93042188
N-(1-phenylethyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119261657
methyl 2-methyl-3-[methyl(pyrrolidine-2-carbonyl)amino]propanoate
CID 60963906
N-[(2-fluorophenyl)methyl]-N-methylpyrrolidine-2-carboxamide
CID 42890905
(2S)-N-(1,3-benzothiazol-2-ylmethyl)-N-methylpyrrolidine-2-carboxamide;dihydrochloride
CID 119835338

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-phenylpropyl)pyrrolidine-2-carboxamide;hydrochloride?
The IUPAC name of N-methyl-N-(2-phenylpropyl)pyrrolidine-2-carboxamide;hydrochloride (CID 119316587) is N-methyl-N-(2-phenylpropyl)pyrrolidine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-methyl-N-(2-phenylpropyl)pyrrolidine-2-carboxamide;hydrochloride?
The canonical SMILES for N-methyl-N-(2-phenylpropyl)pyrrolidine-2-carboxamide;hydrochloride is CC(CN(C)C(=O)C1CCCN1)c1ccccc1.Cl.
What is the InChIKey of N-methyl-N-(2-phenylpropyl)pyrrolidine-2-carboxamide;hydrochloride?
The InChIKey is HRTBGIUYFOEUIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O.ClH/c1-12(13-7-4-3-5-8-13)11-17(2)15(18)14-9-6-10-16-14;/h3-5,7-8,12,14,16H,6,9-11H2,1-2H3;1H.
What are the key properties of N-methyl-N-(2-phenylpropyl)pyrrolidine-2-carboxamide;hydrochloride?
N-methyl-N-(2-phenylpropyl)pyrrolidine-2-carboxamide;hydrochloride has a molecular weight of 282.81 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-phenylpropyl)pyrrolidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119316587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).