4-acetyl-N-(cyclohexylmethyl)-N-pyridin-2-ylmorpholine-2-carboxamide

C19H27N3O3 — CID 136570201

IUPAC4-acetyl-N-(cyclohexylmethyl)-N-pyridin-2-ylmorpholine-2-carboxamide
SMILESCC(=O)N1CCOC(C(=O)N(CC2CCCCC2)c2ccccn2)C1
InChIInChI=1S/C19H27N3O3/c1-15(23)21-11-12-25-17(14-21)19(24)22(18-9-5-6-10-20-18)13-16-7-3-2-4-8-16/h5-6,9-10,16-17H,2-4,7-8,11-14H2,1H3
InChIKeySIICPIOFGXCWBT-UHFFFAOYSA-N
MW345.44 g/mol
LogP2.24
Rot. Bonds4

About 4-acetyl-N-(cyclohexylmethyl)-N-pyridin-2-ylmorpholine-2-carboxamide

4-acetyl-N-(cyclohexylmethyl)-N-pyridin-2-ylmorpholine-2-carboxamide (PubChem CID 136570201) has the molecular formula C19H27N3O3 and a molecular weight of 345.44 g/mol. Its IUPAC name is 4-acetyl-N-(cyclohexylmethyl)-N-pyridin-2-ylmorpholine-2-carboxamide.

Molecular Properties

Compound Name4-acetyl-N-(cyclohexylmethyl)-N-pyridin-2-ylmorpholine-2-carboxamide
PubChem CID136570201
Molecular FormulaC19H27N3O3
Molecular Weight345.44 g/mol
Exact Mass345.21
IUPAC Name4-acetyl-N-(cyclohexylmethyl)-N-pyridin-2-ylmorpholine-2-carboxamide
SMILESCC(=O)N1CCOC(C(=O)N(CC2CCCCC2)c2ccccn2)C1
InChIInChI=1S/C19H27N3O3/c1-15(23)21-11-12-25-17(14-21)19(24)22(18-9-5-6-10-20-18)13-16-7-3-2-4-8-16/h5-6,9-10,16-17H,2-4,7-8,11-14H2,1H3
InChIKeySIICPIOFGXCWBT-UHFFFAOYSA-N
XLogP2.24
TPSA62.74 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(cyclohexylmethyl)-3,5-dimethyl-N-pyridin-2-ylfuran-2-carboxamide
CID 126770730
N-(cyclohexylmethyl)-N-pyridin-2-yl-1,3-thiazole-4-carboxamide
CID 126787255
1-[3-(pyridin-2-ylmethyl)piperidin-1-yl]ethanone
CID 110254207
1-(4-acetylmorpholin-2-yl)ethanone
CID 59110253
1-[3-[(4-pyridin-2-ylpiperidin-1-yl)methyl]piperidin-1-yl]ethanone
CID 54259387
4-acetylmorpholine-2-carboxylic acid
CID 20598078
4-[[carboxy(pyridin-2-yl)amino]methyl]cyclohexane-1-carboxylic acid
CID 145497572
4-acetylmorpholine-2-carboxylic acid;ethane
CID 144675076
2-(cyclohexylmethylamino)-N-methyl-N-pyridin-2-ylacetamide
CID 101057675
N-[2-[(3R)-3-(2-methoxyphenyl)pyrrolidin-1-yl]ethyl]-N-pyridin-2-ylcyclohexanecarboxamide
CID 67628614
N-[2-[3-(2-methoxyphenyl)pyrrolidin-1-yl]ethyl]-N-pyridin-2-ylcyclohexanecarboxamide
CID 15461957
N-(2-piperazin-1-ylethyl)-N-pyridin-2-ylcyclohexanecarboxamide
CID 23170136

Frequently Asked Questions

What is the IUPAC name of 4-acetyl-N-(cyclohexylmethyl)-N-pyridin-2-ylmorpholine-2-carboxamide?
The IUPAC name of 4-acetyl-N-(cyclohexylmethyl)-N-pyridin-2-ylmorpholine-2-carboxamide (CID 136570201) is 4-acetyl-N-(cyclohexylmethyl)-N-pyridin-2-ylmorpholine-2-carboxamide.
What is the SMILES notation for 4-acetyl-N-(cyclohexylmethyl)-N-pyridin-2-ylmorpholine-2-carboxamide?
The canonical SMILES for 4-acetyl-N-(cyclohexylmethyl)-N-pyridin-2-ylmorpholine-2-carboxamide is CC(=O)N1CCOC(C(=O)N(CC2CCCCC2)c2ccccn2)C1.
What is the InChIKey of 4-acetyl-N-(cyclohexylmethyl)-N-pyridin-2-ylmorpholine-2-carboxamide?
The InChIKey is SIICPIOFGXCWBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O3/c1-15(23)21-11-12-25-17(14-21)19(24)22(18-9-5-6-10-20-18)13-16-7-3-2-4-8-16/h5-6,9-10,16-17H,2-4,7-8,11-14H2,1H3.
What are the key properties of 4-acetyl-N-(cyclohexylmethyl)-N-pyridin-2-ylmorpholine-2-carboxamide?
4-acetyl-N-(cyclohexylmethyl)-N-pyridin-2-ylmorpholine-2-carboxamide has a molecular weight of 345.44 g/mol, XLogP of 2.24, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetyl-N-(cyclohexylmethyl)-N-pyridin-2-ylmorpholine-2-carboxamide is sourced from PubChem (CID 136570201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).