1-(2-anilinoacetyl)-6-methylpiperidine-3-carboxamide

C15H21N3O2 — CID 60963532

IUPAC1-(2-anilinoacetyl)-6-methylpiperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1C(=O)CNc1ccccc1
InChIInChI=1S/C15H21N3O2/c1-11-7-8-12(15(16)20)10-18(11)14(19)9-17-13-5-3-2-4-6-13/h2-6,11-12,17H,7-10H2,1H3,(H2,16,20)
InChIKeyBHURFDWEKWZFJX-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.21
Rot. Bonds4

About 1-(2-anilinoacetyl)-6-methylpiperidine-3-carboxamide

1-(2-anilinoacetyl)-6-methylpiperidine-3-carboxamide (PubChem CID 60963532) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 1-(2-anilinoacetyl)-6-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-(2-anilinoacetyl)-6-methylpiperidine-3-carboxamide
PubChem CID60963532
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name1-(2-anilinoacetyl)-6-methylpiperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1C(=O)CNc1ccccc1
InChIInChI=1S/C15H21N3O2/c1-11-7-8-12(15(16)20)10-18(11)14(19)9-17-13-5-3-2-4-6-13/h2-6,11-12,17H,7-10H2,1H3,(H2,16,20)
InChIKeyBHURFDWEKWZFJX-UHFFFAOYSA-N
XLogP1.21
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(2-carbamoylanilino)acetyl]-6-methylpiperidine-3-carboxylic acid
CID 122112866
1-[2-[2-(aminomethyl)phenyl]acetyl]-6-methylpiperidine-3-carboxamide
CID 81312924
1-(2-anilinoacetyl)piperidine-2-carboxamide
CID 54940061
1-(2-anilinoacetyl)pyrrolidine-2-carboxamide
CID 60860590
1-(3-aminopropanoyl)-6-methylpiperidine-3-carboxamide;hydrochloride
CID 119291566
1-(2-anilinoacetyl)-4-hydroxypyrrolidine-2-carboxamide
CID 54874193
1-[(2R)-2-amino-3-phenylpropanoyl]-6-methylpiperidine-3-carboxamide
CID 78984554
(3R,6R)-1-[2-(2-fluorophenoxy)acetyl]-6-methylpiperidine-3-carboxamide
CID 94482779
(3S,6S)-1-[2-(2-ethylphenoxy)acetyl]-6-methylpiperidine-3-carboxamide
CID 94809382
(3S,6S)-6-methyl-1-[2-(2-phenyltriazol-4-yl)acetyl]piperidine-3-carboxamide
CID 95151645
(3R,6S)-1-[2-(4-bromophenyl)acetyl]-6-methylpiperidine-3-carboxamide
CID 94200570
(3R,6S)-1-[3-[(4-tert-butylbenzoyl)amino]propanoyl]-6-methylpiperidine-3-carboxamide
CID 51957513

Frequently Asked Questions

What is the IUPAC name of 1-(2-anilinoacetyl)-6-methylpiperidine-3-carboxamide?
The IUPAC name of 1-(2-anilinoacetyl)-6-methylpiperidine-3-carboxamide (CID 60963532) is 1-(2-anilinoacetyl)-6-methylpiperidine-3-carboxamide.
What is the SMILES notation for 1-(2-anilinoacetyl)-6-methylpiperidine-3-carboxamide?
The canonical SMILES for 1-(2-anilinoacetyl)-6-methylpiperidine-3-carboxamide is CC1CCC(C(N)=O)CN1C(=O)CNc1ccccc1.
What is the InChIKey of 1-(2-anilinoacetyl)-6-methylpiperidine-3-carboxamide?
The InChIKey is BHURFDWEKWZFJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-11-7-8-12(15(16)20)10-18(11)14(19)9-17-13-5-3-2-4-6-13/h2-6,11-12,17H,7-10H2,1H3,(H2,16,20).
What are the key properties of 1-(2-anilinoacetyl)-6-methylpiperidine-3-carboxamide?
1-(2-anilinoacetyl)-6-methylpiperidine-3-carboxamide has a molecular weight of 275.35 g/mol, XLogP of 1.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-anilinoacetyl)-6-methylpiperidine-3-carboxamide is sourced from PubChem (CID 60963532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).