(3R)-N-[2-(dimethylamino)phenyl]piperidine-3-carboxamide

C14H21N3O — CID 81124791

IUPAC(3R)-N-[2-(dimethylamino)phenyl]piperidine-3-carboxamide
SMILESCN(C)c1ccccc1NC(=O)[C@@H]1CCCNC1
InChIInChI=1S/C14H21N3O/c1-17(2)13-8-4-3-7-12(13)16-14(18)11-6-5-9-15-10-11/h3-4,7-8,11,15H,5-6,9-10H2,1-2H3,(H,16,18)/t11-/m1/s1
InChIKeyBHFBTBXYAUHKFO-LLVKDONJSA-N
MW247.34 g/mol
LogP1.69
Rot. Bonds3

About (3R)-N-[2-(dimethylamino)phenyl]piperidine-3-carboxamide

(3R)-N-[2-(dimethylamino)phenyl]piperidine-3-carboxamide (PubChem CID 81124791) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is (3R)-N-[2-(dimethylamino)phenyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-[2-(dimethylamino)phenyl]piperidine-3-carboxamide
PubChem CID81124791
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name(3R)-N-[2-(dimethylamino)phenyl]piperidine-3-carboxamide
SMILESCN(C)c1ccccc1NC(=O)[C@@H]1CCCNC1
InChIInChI=1S/C14H21N3O/c1-17(2)13-8-4-3-7-12(13)16-14(18)11-6-5-9-15-10-11/h3-4,7-8,11,15H,5-6,9-10H2,1-2H3,(H,16,18)/t11-/m1/s1
InChIKeyBHFBTBXYAUHKFO-LLVKDONJSA-N
XLogP1.69
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(methylcarbamoyl)phenyl]piperidine-3-carboxamide
CID 18071955
N-(2-ethylphenyl)piperidine-3-carboxamide;hydrochloride
CID 119265832
N-(2-methylsulfonylphenyl)piperidine-3-carboxamide
CID 43709740
3-amino-N-[2-(dimethylamino)phenyl]cyclohexane-1-carboxamide
CID 63044143
N-(2-benzamidophenyl)piperidine-3-carboxamide;hydrochloride
CID 119282577
(3S)-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]piperidine-3-carboxamide
CID 81124526
N-(2-ethoxyphenyl)piperidine-3-carboxamide
CID 18072790
N-[3-(dimethylamino)-4-methylphenyl]piperidine-3-carboxamide
CID 115377234
(3S)-N-[4-(dimethylamino)phenyl]piperidine-3-carboxamide
CID 28807397
N-[2-(dimethylamino)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 78981788
N-[2-(dimethylamino)phenyl]-3-methylpyrrolidine-2-carboxamide
CID 102778094
(3R)-N-(2-methylphenyl)pyrrolidine-3-carboxamide
CID 94915623

Frequently Asked Questions

What is the IUPAC name of (3R)-N-[2-(dimethylamino)phenyl]piperidine-3-carboxamide?
The IUPAC name of (3R)-N-[2-(dimethylamino)phenyl]piperidine-3-carboxamide (CID 81124791) is (3R)-N-[2-(dimethylamino)phenyl]piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-[2-(dimethylamino)phenyl]piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-[2-(dimethylamino)phenyl]piperidine-3-carboxamide is CN(C)c1ccccc1NC(=O)[C@@H]1CCCNC1.
What is the InChIKey of (3R)-N-[2-(dimethylamino)phenyl]piperidine-3-carboxamide?
The InChIKey is BHFBTBXYAUHKFO-LLVKDONJSA-N. The full InChI is InChI=1S/C14H21N3O/c1-17(2)13-8-4-3-7-12(13)16-14(18)11-6-5-9-15-10-11/h3-4,7-8,11,15H,5-6,9-10H2,1-2H3,(H,16,18)/t11-/m1/s1.
What are the key properties of (3R)-N-[2-(dimethylamino)phenyl]piperidine-3-carboxamide?
(3R)-N-[2-(dimethylamino)phenyl]piperidine-3-carboxamide has a molecular weight of 247.34 g/mol, XLogP of 1.69, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[2-(dimethylamino)phenyl]piperidine-3-carboxamide is sourced from PubChem (CID 81124791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).