2-[cyclohexyl(methyl)amino]-N-(ethylcarbamoyl)acetamide

C12H23N3O2 — CID 46800805

IUPAC2-[cyclohexyl(methyl)amino]-N-(ethylcarbamoyl)acetamide
SMILESCCNC(=O)NC(=O)CN(C)C1CCCCC1
InChIInChI=1S/C12H23N3O2/c1-3-13-12(17)14-11(16)9-15(2)10-7-5-4-6-8-10/h10H,3-9H2,1-2H3,(H2,13,14,16,17)
InChIKeyGASBDNHUAGTJKG-UHFFFAOYSA-N
MW241.33 g/mol
LogP1.10
Rot. Bonds4

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

2-[cyclohexyl(methyl)amino]-N-(ethylcarbamoyl)acetamide (PubChem CID 46800805) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-[cyclohexyl(methyl)amino]-N-(ethylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-[cyclohexyl(methyl)amino]-N-(ethylcarbamoyl)acetamide
PubChem CID46800805
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name2-[cyclohexyl(methyl)amino]-N-(ethylcarbamoyl)acetamide
SMILESCCNC(=O)NC(=O)CN(C)C1CCCCC1
InChIInChI=1S/C12H23N3O2/c1-3-13-12(17)14-11(16)9-15(2)10-7-5-4-6-8-10/h10H,3-9H2,1-2H3,(H2,13,14,16,17)
InChIKeyGASBDNHUAGTJKG-UHFFFAOYSA-N
XLogP1.10
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cycloheptyl(methyl)amino]-N-(ethylcarbamoyl)acetamide
CID 16577824
2-[cyclohexyl(methyl)amino]-N-(propylcarbamoyl)acetamide
CID 40706145
N-(ethylcarbamoyl)-2-[methyl(piperidin-4-yl)amino]acetamide
CID 43607364
2-[cyclohexyl(methyl)amino]-N-(cyclopropylcarbamoyl)acetamide
CID 40706155
2-[cyclopentyl(methyl)amino]-N-(cyclopropylcarbamoyl)acetamide
CID 47126757
2-[cycloheptyl(methyl)amino]acetohydrazide
CID 63574269
2-[[2-[cyclohexyl(methyl)amino]acetyl]amino]acetic acid
CID 39258593
2-[[2-[cyclopropyl(methyl)amino]acetyl]amino]-N-ethylacetamide
CID 55628038
cyclooctyl-[2-(ethylcarbamoylamino)-2-oxoethyl]azanium
CID 9265109
2-[(3-aminocyclohexyl)-methylamino]-N-ethylacetamide
CID 79469564
2-[cyclopropyl(piperidin-2-ylmethyl)amino]-N-(ethylcarbamoyl)acetamide
CID 106631667
2-[azepan-4-yl(methyl)amino]-N-(methylcarbamoyl)acetamide
CID 104979461

Frequently Asked Questions

What is the IUPAC name of 2-[cyclohexyl(methyl)amino]-N-(ethylcarbamoyl)acetamide?
The IUPAC name of 2-[cyclohexyl(methyl)amino]-N-(ethylcarbamoyl)acetamide (CID 46800805) is 2-[cyclohexyl(methyl)amino]-N-(ethylcarbamoyl)acetamide.
What is the SMILES notation for 2-[cyclohexyl(methyl)amino]-N-(ethylcarbamoyl)acetamide?
The canonical SMILES for 2-[cyclohexyl(methyl)amino]-N-(ethylcarbamoyl)acetamide is CCNC(=O)NC(=O)CN(C)C1CCCCC1.
What is the InChIKey of 2-[cyclohexyl(methyl)amino]-N-(ethylcarbamoyl)acetamide?
The InChIKey is GASBDNHUAGTJKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-3-13-12(17)14-11(16)9-15(2)10-7-5-4-6-8-10/h10H,3-9H2,1-2H3,(H2,13,14,16,17).
What are the key properties of 2-[cyclohexyl(methyl)amino]-N-(ethylcarbamoyl)acetamide?
2-[cyclohexyl(methyl)amino]-N-(ethylcarbamoyl)acetamide has a molecular weight of 241.33 g/mol, XLogP of 1.10, 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-(ethylcarbamoyl)acetamide is sourced from PubChem (CID 46800805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).