2-methyl-3-N-phenylpiperidine-1,3-dicarboxamide

C14H19N3O2 — CID 66701465

IUPAC2-methyl-3-N-phenylpiperidine-1,3-dicarboxamide
SMILESCC1C(C(=O)Nc2ccccc2)CCCN1C(N)=O
InChIInChI=1S/C14H19N3O2/c1-10-12(8-5-9-17(10)14(15)19)13(18)16-11-6-3-2-4-7-11/h2-4,6-7,10,12H,5,8-9H2,1H3,(H2,15,19)(H,16,18)
InChIKeyQVVNTHAXHRJKQD-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.80
Rot. Bonds2

About 2-methyl-3-N-phenylpiperidine-1,3-dicarboxamide

2-methyl-3-N-phenylpiperidine-1,3-dicarboxamide (PubChem CID 66701465) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 2-methyl-3-N-phenylpiperidine-1,3-dicarboxamide.

Molecular Properties

Compound Name2-methyl-3-N-phenylpiperidine-1,3-dicarboxamide
PubChem CID66701465
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name2-methyl-3-N-phenylpiperidine-1,3-dicarboxamide
SMILESCC1C(C(=O)Nc2ccccc2)CCCN1C(N)=O
InChIInChI=1S/C14H19N3O2/c1-10-12(8-5-9-17(10)14(15)19)13(18)16-11-6-3-2-4-7-11/h2-4,6-7,10,12H,5,8-9H2,1H3,(H2,15,19)(H,16,18)
InChIKeyQVVNTHAXHRJKQD-UHFFFAOYSA-N
XLogP1.80
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-carbamoyl-2-methylpiperidine-3-carboxylic acid
CID 130961604
trans-(1R,2R)-1-N,2-N-diphenylcyclohexane-1,2-dicarboxamide
CID 15685590
trans-(1S,2S)-2-(phenylcarbamoyl)cyclohexane-1-carboxylic acid
CID 41097609
(2R,3R)-1-(4-benzamidobenzoyl)-2-methylpiperidine-3-carboxylic acid
CID 122115249
(2S)-2-(phenylcarbamoyl)pyrrolidine-1-carboxylic acid
CID 69195937
trans-(1R,2R)-2-amino-N-phenylcyclohexane-1-carboxamide
CID 10889384
trans-(1R,2R)-N-phenyl-2-piperidin-1-ylcyclohexane-1-carboxamide
CID 125470128
2-(dimethylamino)-N-phenylcyclohexane-1-carboxamide
CID 71440267
(2S)-1-[(2S)-2-aminopropanoyl]-N-phenylpyrrolidine-2-carboxamide
CID 22809937
(2S)-1-(4-methylbenzoyl)-N-phenylpyrrolidine-2-carboxamide
CID 92668343
cis-(1S,2R)-2-[(4-anilinophenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 696808
2-[(3-carbamoylphenyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103977967

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-N-phenylpiperidine-1,3-dicarboxamide?
The IUPAC name of 2-methyl-3-N-phenylpiperidine-1,3-dicarboxamide (CID 66701465) is 2-methyl-3-N-phenylpiperidine-1,3-dicarboxamide.
What is the SMILES notation for 2-methyl-3-N-phenylpiperidine-1,3-dicarboxamide?
The canonical SMILES for 2-methyl-3-N-phenylpiperidine-1,3-dicarboxamide is CC1C(C(=O)Nc2ccccc2)CCCN1C(N)=O.
What is the InChIKey of 2-methyl-3-N-phenylpiperidine-1,3-dicarboxamide?
The InChIKey is QVVNTHAXHRJKQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-10-12(8-5-9-17(10)14(15)19)13(18)16-11-6-3-2-4-7-11/h2-4,6-7,10,12H,5,8-9H2,1H3,(H2,15,19)(H,16,18).
What are the key properties of 2-methyl-3-N-phenylpiperidine-1,3-dicarboxamide?
2-methyl-3-N-phenylpiperidine-1,3-dicarboxamide has a molecular weight of 261.32 g/mol, XLogP of 1.80, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-N-phenylpiperidine-1,3-dicarboxamide is sourced from PubChem (CID 66701465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).