(3-ethylpiperidin-1-yl)-[2-(methylamino)phenyl]methanone

C15H22N2O — CID 61377467

IUPAC(3-ethylpiperidin-1-yl)-[2-(methylamino)phenyl]methanone
SMILESCCC1CCCN(C(=O)c2ccccc2NC)C1
InChIInChI=1S/C15H22N2O/c1-3-12-7-6-10-17(11-12)15(18)13-8-4-5-9-14(13)16-2/h4-5,8-9,12,16H,3,6-7,10-11H2,1-2H3
InChIKeyWASWGUJHZOELMM-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.99
Rot. Bonds3

About (3-ethylpiperidin-1-yl)-[2-(methylamino)phenyl]methanone

(3-ethylpiperidin-1-yl)-[2-(methylamino)phenyl]methanone (PubChem CID 61377467) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is (3-ethylpiperidin-1-yl)-[2-(methylamino)phenyl]methanone.

Molecular Properties

Compound Name(3-ethylpiperidin-1-yl)-[2-(methylamino)phenyl]methanone
PubChem CID61377467
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name(3-ethylpiperidin-1-yl)-[2-(methylamino)phenyl]methanone
SMILESCCC1CCCN(C(=O)c2ccccc2NC)C1
InChIInChI=1S/C15H22N2O/c1-3-12-7-6-10-17(11-12)15(18)13-8-4-5-9-14(13)16-2/h4-5,8-9,12,16H,3,6-7,10-11H2,1-2H3
InChIKeyWASWGUJHZOELMM-UHFFFAOYSA-N
XLogP2.99
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(3-ethylpiperidine-1-carbonyl)phenyl]ethanesulfonamide
CID 51096518
2-(3-ethylpiperidine-1-carbonyl)benzoic acid
CID 43584267
ethyl 1-[2-(methylamino)benzoyl]piperidine-3-carboxylate
CID 61377643
(2-chloro-3-pyridinyl)-(3-ethylpiperidin-1-yl)methanone
CID 43430237
N-[2-[3-(methylaminomethyl)piperidine-1-carbonyl]phenyl]ethanesulfonamide
CID 119398279
(2-anilinophenyl)-[3-(methylaminomethyl)piperidin-1-yl]methanone
CID 119395281
(3-ethylpiperidin-1-yl)-[2-(methylamino)-3-nitrophenyl]methanone
CID 115936544
(3-ethylpiperidin-1-yl)-(2-hydroxy-3-methylphenyl)methanone
CID 43430135
aziridin-1-yl-[2-(methylamino)phenyl]methanone
CID 165349679
3-ethyl-N-(2-ethylphenyl)piperidine-1-carboxamide
CID 86987456
2-[3-(methylaminomethyl)piperidine-1-carbonyl]benzoic acid
CID 61403916
(3S)-N-(2-bromophenyl)-3-ethylpiperidine-1-carboxamide
CID 51944008

Frequently Asked Questions

What is the IUPAC name of (3-ethylpiperidin-1-yl)-[2-(methylamino)phenyl]methanone?
The IUPAC name of (3-ethylpiperidin-1-yl)-[2-(methylamino)phenyl]methanone (CID 61377467) is (3-ethylpiperidin-1-yl)-[2-(methylamino)phenyl]methanone.
What is the SMILES notation for (3-ethylpiperidin-1-yl)-[2-(methylamino)phenyl]methanone?
The canonical SMILES for (3-ethylpiperidin-1-yl)-[2-(methylamino)phenyl]methanone is CCC1CCCN(C(=O)c2ccccc2NC)C1.
What is the InChIKey of (3-ethylpiperidin-1-yl)-[2-(methylamino)phenyl]methanone?
The InChIKey is WASWGUJHZOELMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-3-12-7-6-10-17(11-12)15(18)13-8-4-5-9-14(13)16-2/h4-5,8-9,12,16H,3,6-7,10-11H2,1-2H3.
What are the key properties of (3-ethylpiperidin-1-yl)-[2-(methylamino)phenyl]methanone?
(3-ethylpiperidin-1-yl)-[2-(methylamino)phenyl]methanone has a molecular weight of 246.35 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethylpiperidin-1-yl)-[2-(methylamino)phenyl]methanone is sourced from PubChem (CID 61377467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).