2-[cyclohexyl(methyl)amino]-N-(propan-2-ylcarbamoyl)acetamide

C13H25N3O2 — CID 17451459

IUPAC2-[cyclohexyl(methyl)amino]-N-(propan-2-ylcarbamoyl)acetamide
SMILESCC(C)NC(=O)NC(=O)CN(C)C1CCCCC1
InChIInChI=1S/C13H25N3O2/c1-10(2)14-13(18)15-12(17)9-16(3)11-7-5-4-6-8-11/h10-11H,4-9H2,1-3H3,(H2,14,15,17,18)
InChIKeyOQLXIFBWFZOGRE-UHFFFAOYSA-N
MW255.36 g/mol
LogP1.49
Rot. Bonds4

About 2-[cyclohexyl(methyl)amino]-N-(propan-2-ylcarbamoyl)acetamide

2-[cyclohexyl(methyl)amino]-N-(propan-2-ylcarbamoyl)acetamide (PubChem CID 17451459) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is 2-[cyclohexyl(methyl)amino]-N-(propan-2-ylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-[cyclohexyl(methyl)amino]-N-(propan-2-ylcarbamoyl)acetamide
PubChem CID17451459
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC Name2-[cyclohexyl(methyl)amino]-N-(propan-2-ylcarbamoyl)acetamide
SMILESCC(C)NC(=O)NC(=O)CN(C)C1CCCCC1
InChIInChI=1S/C13H25N3O2/c1-10(2)14-13(18)15-12(17)9-16(3)11-7-5-4-6-8-11/h10-11H,4-9H2,1-3H3,(H2,14,15,17,18)
InChIKeyOQLXIFBWFZOGRE-UHFFFAOYSA-N
XLogP1.49
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclopentylcarbamoyl)-2-pyrrolidin-1-ylacetamide
CID 2458853
2-(azocan-1-yl)-N-(cyclohexylcarbamoyl)acetamide
CID 2461765
N-cyclohexyl-2-(1,3-dimethyl-2,5-dioxoimidazolidin-4-yl)acetamide
CID 4917364
N-(cyclohexylcarbamoyl)-2-(4-methylpiperazin-1-yl)acetamide
CID 8896226
N-(cyclohexylcarbamoyl)-2-(3-methylpiperidin-1-yl)acetamide
CID 16286794
N-[1-cyclohexyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]acetamide
CID 3692535
1-Cyclohexylimidazolidine-2,4,5-trione
CID 12435815
N-[2-(diethylamino)ethyl](cyclohexylamino)carboxamide
CID 2054543
4-(2-amino-2-oxoethyl)-N-cyclohexylpiperazine-1-carboxamide
CID 2056604
N-(cyclopentylcarbamoyl)-2-piperidin-1-ylacetamide
CID 2465977
N-cyclohexyl-2-(1,3-diethyl-2,5-dioxoimidazolidin-4-yl)acetamide
CID 2954390
N-cyclohexyl-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 2109987

Frequently Asked Questions

What is the IUPAC name of 2-[cyclohexyl(methyl)amino]-N-(propan-2-ylcarbamoyl)acetamide?
The IUPAC name of 2-[cyclohexyl(methyl)amino]-N-(propan-2-ylcarbamoyl)acetamide (CID 17451459) is 2-[cyclohexyl(methyl)amino]-N-(propan-2-ylcarbamoyl)acetamide.
What is the SMILES notation for 2-[cyclohexyl(methyl)amino]-N-(propan-2-ylcarbamoyl)acetamide?
The canonical SMILES for 2-[cyclohexyl(methyl)amino]-N-(propan-2-ylcarbamoyl)acetamide is CC(C)NC(=O)NC(=O)CN(C)C1CCCCC1.
What is the InChIKey of 2-[cyclohexyl(methyl)amino]-N-(propan-2-ylcarbamoyl)acetamide?
The InChIKey is OQLXIFBWFZOGRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-10(2)14-13(18)15-12(17)9-16(3)11-7-5-4-6-8-11/h10-11H,4-9H2,1-3H3,(H2,14,15,17,18).
What are the key properties of 2-[cyclohexyl(methyl)amino]-N-(propan-2-ylcarbamoyl)acetamide?
2-[cyclohexyl(methyl)amino]-N-(propan-2-ylcarbamoyl)acetamide has a molecular weight of 255.36 g/mol, XLogP of 1.49, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclohexyl(methyl)amino]-N-(propan-2-ylcarbamoyl)acetamide is sourced from PubChem (CID 17451459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).