N-methyl-N-(1-phenylpiperidin-3-yl)pyrrolidine-3-carboxamide

C17H25N3O — CID 119889712

IUPACN-methyl-N-(1-phenylpiperidin-3-yl)pyrrolidine-3-carboxamide
SMILESCN(C(=O)C1CCNC1)C1CCCN(c2ccccc2)C1
InChIInChI=1S/C17H25N3O/c1-19(17(21)14-9-10-18-12-14)16-8-5-11-20(13-16)15-6-3-2-4-7-15/h2-4,6-7,14,16,18H,5,8-13H2,1H3
InChIKeyAEYAFMHVJMDPDM-UHFFFAOYSA-N
MW287.41 g/mol
LogP1.72
Rot. Bonds3

About N-methyl-N-(1-phenylpiperidin-3-yl)pyrrolidine-3-carboxamide

N-methyl-N-(1-phenylpiperidin-3-yl)pyrrolidine-3-carboxamide (PubChem CID 119889712) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is N-methyl-N-(1-phenylpiperidin-3-yl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(1-phenylpiperidin-3-yl)pyrrolidine-3-carboxamide
PubChem CID119889712
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC NameN-methyl-N-(1-phenylpiperidin-3-yl)pyrrolidine-3-carboxamide
SMILESCN(C(=O)C1CCNC1)C1CCCN(c2ccccc2)C1
InChIInChI=1S/C17H25N3O/c1-19(17(21)14-9-10-18-12-14)16-8-5-11-20(13-16)15-6-3-2-4-7-15/h2-4,6-7,14,16,18H,5,8-13H2,1H3
InChIKeyAEYAFMHVJMDPDM-UHFFFAOYSA-N
XLogP1.72
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-methyl-N-(1-phenylpiperidin-3-yl)cyclohexane-1-carboxamide
CID 119889662
3-amino-N-methyl-N-(1-phenylpiperidin-3-yl)cyclohexane-1-carboxamide;dihydrochloride
CID 119889661
N-(1-benzylpiperidin-3-yl)-N-methylpiperidine-3-carboxamide;dihydrochloride
CID 119857542
3-ethyl-1-methyl-1-(1-phenylpiperidin-3-yl)urea
CID 136526166
N-(2,3-dihydro-1H-inden-2-yl)-N-methylpyrrolidine-3-carboxamide;hydrochloride
CID 119746215
2-amino-N-methyl-N-(1-phenylpiperidin-3-yl)benzamide
CID 119947279
4-amino-N-methyl-N-(1-phenylpiperidin-3-yl)butanamide
CID 119889710
N-[(2R)-1-[methyl-[(3R)-1-phenylpiperidin-3-yl]amino]-1-oxopropan-2-yl]cyclobutanecarboxamide
CID 97061605
(3R)-N-cyclopropyl-N-methylpyrrolidine-3-carboxamide
CID 94915741
N-methyl-N-(1-phenylethyl)pyrrolidine-3-carboxamide
CID 63005298
(3S)-N-methyl-N-pyrrolidin-3-ylpyrrolidine-3-carboxamide
CID 131110681
(4-phenyl-1,4-diazepan-1-yl)-pyrrolidin-3-ylmethanone;dihydrochloride
CID 119860825

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-phenylpiperidin-3-yl)pyrrolidine-3-carboxamide?
The IUPAC name of N-methyl-N-(1-phenylpiperidin-3-yl)pyrrolidine-3-carboxamide (CID 119889712) is N-methyl-N-(1-phenylpiperidin-3-yl)pyrrolidine-3-carboxamide.
What is the SMILES notation for N-methyl-N-(1-phenylpiperidin-3-yl)pyrrolidine-3-carboxamide?
The canonical SMILES for N-methyl-N-(1-phenylpiperidin-3-yl)pyrrolidine-3-carboxamide is CN(C(=O)C1CCNC1)C1CCCN(c2ccccc2)C1.
What is the InChIKey of N-methyl-N-(1-phenylpiperidin-3-yl)pyrrolidine-3-carboxamide?
The InChIKey is AEYAFMHVJMDPDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c1-19(17(21)14-9-10-18-12-14)16-8-5-11-20(13-16)15-6-3-2-4-7-15/h2-4,6-7,14,16,18H,5,8-13H2,1H3.
What are the key properties of N-methyl-N-(1-phenylpiperidin-3-yl)pyrrolidine-3-carboxamide?
N-methyl-N-(1-phenylpiperidin-3-yl)pyrrolidine-3-carboxamide has a molecular weight of 287.41 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-phenylpiperidin-3-yl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 119889712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).