(2R)-2-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide

C16H29N3O3 — CID 51715596

IUPAC(2R)-2-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide
SMILESCC(=O)N[C@H](C)C(=O)NCC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C16H29N3O3/c1-13(18-14(2)20)15(21)17-12-16(6-4-3-5-7-16)19-8-10-22-11-9-19/h13H,3-12H2,1-2H3,(H,17,21)(H,18,20)/t13-/m1/s1
InChIKeyBOEVKAIPBACNRS-CYBMUJFWSA-N
MW311.43 g/mol
LogP0.66
Rot. Bonds5

About (2R)-2-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide

(2R)-2-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide (PubChem CID 51715596) has the molecular formula C16H29N3O3 and a molecular weight of 311.43 g/mol. Its IUPAC name is (2R)-2-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide.

Molecular Properties

Compound Name(2R)-2-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide
PubChem CID51715596
Molecular FormulaC16H29N3O3
Molecular Weight311.43 g/mol
Exact Mass311.22
IUPAC Name(2R)-2-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide
SMILESCC(=O)N[C@H](C)C(=O)NCC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C16H29N3O3/c1-13(18-14(2)20)15(21)17-12-16(6-4-3-5-7-16)19-8-10-22-11-9-19/h13H,3-12H2,1-2H3,(H,17,21)(H,18,20)/t13-/m1/s1
InChIKeyBOEVKAIPBACNRS-CYBMUJFWSA-N
XLogP0.66
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2R)-1-[(1-morpholin-4-ylcyclohexyl)methylamino]-1-oxopropan-2-yl]benzamide
CID 31328196
(2R)-2-amino-4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pentanamide
CID 56875780
2-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pentanamide
CID 78789816
2-amino-3-methoxy-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide
CID 120983514
(2S)-2-acetamido-3-methyl-N-[(4-piperidin-1-yloxan-4-yl)methyl]butanamide
CID 95619748
2-[(4-chlorophenyl)sulfonylamino]-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide
CID 55348790
(2S)-2-(2-methoxyphenoxy)-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide
CID 34948785
2-(4-ethylphenoxy)-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide
CID 17014106
(2S)-N-(methylcarbamoyl)-2-[(1-morpholin-4-ylcyclohexyl)methylamino]propanamide
CID 51980815
2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide
CID 51223648
3,3-dimethyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]butanamide
CID 78789271
2-acetamido-N-[[1-(hydroxymethyl)cyclohexyl]methyl]propanamide
CID 112699726

Frequently Asked Questions

What is the IUPAC name of (2R)-2-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide?
The IUPAC name of (2R)-2-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide (CID 51715596) is (2R)-2-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide.
What is the SMILES notation for (2R)-2-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide?
The canonical SMILES for (2R)-2-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide is CC(=O)N[C@H](C)C(=O)NCC1(N2CCOCC2)CCCCC1.
What is the InChIKey of (2R)-2-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide?
The InChIKey is BOEVKAIPBACNRS-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H29N3O3/c1-13(18-14(2)20)15(21)17-12-16(6-4-3-5-7-16)19-8-10-22-11-9-19/h13H,3-12H2,1-2H3,(H,17,21)(H,18,20)/t13-/m1/s1.
What are the key properties of (2R)-2-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide?
(2R)-2-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide has a molecular weight of 311.43 g/mol, XLogP of 0.66, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-acetamido-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide is sourced from PubChem (CID 51715596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).