N-carbamoyl-2-(1-cyclohexylethylamino)propanamide

C12H23N3O2 — CID 62405397

IUPACN-carbamoyl-2-(1-cyclohexylethylamino)propanamide
SMILESCC(NC(C)C1CCCCC1)C(=O)NC(N)=O
InChIInChI=1S/C12H23N3O2/c1-8(10-6-4-3-5-7-10)14-9(2)11(16)15-12(13)17/h8-10,14H,3-7H2,1-2H3,(H3,13,15,16,17)
InChIKeyOKXWQADITXHDCU-UHFFFAOYSA-N
MW241.33 g/mol
LogP1.13
Rot. Bonds4

About N-carbamoyl-2-(1-cyclohexylethylamino)propanamide

N-carbamoyl-2-(1-cyclohexylethylamino)propanamide (PubChem CID 62405397) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is N-carbamoyl-2-(1-cyclohexylethylamino)propanamide.

Molecular Properties

Compound NameN-carbamoyl-2-(1-cyclohexylethylamino)propanamide
PubChem CID62405397
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC NameN-carbamoyl-2-(1-cyclohexylethylamino)propanamide
SMILESCC(NC(C)C1CCCCC1)C(=O)NC(N)=O
InChIInChI=1S/C12H23N3O2/c1-8(10-6-4-3-5-7-10)14-9(2)11(16)15-12(13)17/h8-10,14H,3-7H2,1-2H3,(H3,13,15,16,17)
InChIKeyOKXWQADITXHDCU-UHFFFAOYSA-N
XLogP1.13
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 51.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-carbamoyl-2-[[(1R)-1-cycloheptylethyl]amino]propanamide
CID 81391633
N-carbamoyl-2-[[(1R)-1-cyclopentylethyl]amino]propanamide
CID 81394882
N-carbamoyl-2-(1-cyclobutylethylamino)propanamide
CID 115766420
N-carbamoyl-2-(1-cyclopropylethylamino)propanamide
CID 43401268
2-[[(1R)-1-cycloheptylethyl]amino]-N-(methylcarbamoyl)propanamide
CID 81392646
N-cyclohexyl-2-[[(1S)-1-cyclohexylethyl]amino]propanamide
CID 81384329
2-[[(1S)-1-cyclohexylethyl]amino]-N-methylpropanamide
CID 81384429
N-cyclohexyl-2-[[(1R)-1-cyclohexylethyl]amino]propanamide
CID 81384882
2-(1-cyclohexylethylamino)-N-cyclopropylpropanamide
CID 62405745
methyl 2-[[(1S)-1-cyclopentylethyl]amino]propanoate
CID 81386105
N-tert-butyl-2-(1-cyclohexylethylamino)propanamide
CID 62405402
2-[[(1R)-1-cyclohexylethyl]amino]-N-(2-methylpropyl)propanamide
CID 81385143

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-(1-cyclohexylethylamino)propanamide?
The IUPAC name of N-carbamoyl-2-(1-cyclohexylethylamino)propanamide (CID 62405397) is N-carbamoyl-2-(1-cyclohexylethylamino)propanamide.
What is the SMILES notation for N-carbamoyl-2-(1-cyclohexylethylamino)propanamide?
The canonical SMILES for N-carbamoyl-2-(1-cyclohexylethylamino)propanamide is CC(NC(C)C1CCCCC1)C(=O)NC(N)=O.
What is the InChIKey of N-carbamoyl-2-(1-cyclohexylethylamino)propanamide?
The InChIKey is OKXWQADITXHDCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-8(10-6-4-3-5-7-10)14-9(2)11(16)15-12(13)17/h8-10,14H,3-7H2,1-2H3,(H3,13,15,16,17).
What are the key properties of N-carbamoyl-2-(1-cyclohexylethylamino)propanamide?
N-carbamoyl-2-(1-cyclohexylethylamino)propanamide has a molecular weight of 241.33 g/mol, XLogP of 1.13, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-(1-cyclohexylethylamino)propanamide is sourced from PubChem (CID 62405397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).