3-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide

C20H29N3O3 — CID 18150674

IUPAC3-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
SMILESCC(=O)Nc1cccc(C(=O)NCC2(N3CCOCC3)CCCCC2)c1
InChIInChI=1S/C20H29N3O3/c1-16(24)22-18-7-5-6-17(14-18)19(25)21-15-20(8-3-2-4-9-20)23-10-12-26-13-11-23/h5-7,14H,2-4,8-13,15H2,1H3,(H,21,25)(H,22,24)
InChIKeyBCKRJCXFFQQOOX-UHFFFAOYSA-N
MW359.47 g/mol
LogP2.41
Rot. Bonds5

About 3-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide

3-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide (PubChem CID 18150674) has the molecular formula C20H29N3O3 and a molecular weight of 359.47 g/mol. Its IUPAC name is 3-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide.

Molecular Properties

Compound Name3-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
PubChem CID18150674
Molecular FormulaC20H29N3O3
Molecular Weight359.47 g/mol
Exact Mass359.22
IUPAC Name3-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
SMILESCC(=O)Nc1cccc(C(=O)NCC2(N3CCOCC3)CCCCC2)c1
InChIInChI=1S/C20H29N3O3/c1-16(24)22-18-7-5-6-17(14-18)19(25)21-15-20(8-3-2-4-9-20)23-10-12-26-13-11-23/h5-7,14H,2-4,8-13,15H2,1H3,(H,21,25)(H,22,24)
InChIKeyBCKRJCXFFQQOOX-UHFFFAOYSA-N
XLogP2.41
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-pyrrol-1-ylbenzamide
CID 17404060
3-fluoro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide
CID 139028737
N-[(4-morpholin-4-yloxan-4-yl)methyl]-3-(prop-2-enoylamino)benzamide
CID 166407354
3-bromo-N-[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxoethyl]benzamide
CID 18150703
4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
CID 2559826
N-[(1-morpholin-4-ylcyclohexyl)methyl]-3-piperidin-1-ylsulfonylbenzamide
CID 17391709
3-fluoro-N-[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxoethyl]benzamide
CID 78784195
3,4-diethoxy-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
CID 35762390
3-methoxy-N-[(4-morpholin-4-yloxan-4-yl)methyl]benzamide
CID 125420203
3-methyl-N-[2-[[N'-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]carbamimidoyl]amino]ethyl]benzamide
CID 111004431
3-fluoro-N-[(1-methyl-4-morpholin-4-ylpiperidin-4-yl)methyl]benzamide
CID 112505015
N-[4-[(1-morpholin-4-ylcyclohexyl)methylcarbamoyl]phenyl]furan-2-carboxamide
CID 9405434

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide?
The IUPAC name of 3-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide (CID 18150674) is 3-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide.
What is the SMILES notation for 3-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide?
The canonical SMILES for 3-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide is CC(=O)Nc1cccc(C(=O)NCC2(N3CCOCC3)CCCCC2)c1.
What is the InChIKey of 3-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide?
The InChIKey is BCKRJCXFFQQOOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O3/c1-16(24)22-18-7-5-6-17(14-18)19(25)21-15-20(8-3-2-4-9-20)23-10-12-26-13-11-23/h5-7,14H,2-4,8-13,15H2,1H3,(H,21,25)(H,22,24).
What are the key properties of 3-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide?
3-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide has a molecular weight of 359.47 g/mol, XLogP of 2.41, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide is sourced from PubChem (CID 18150674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).