N-(4-methylcyclohexyl)-2-(propylamino)acetamide

C12H24N2O — CID 60671942

IUPACN-(4-methylcyclohexyl)-2-(propylamino)acetamide
SMILESCCCNCC(=O)NC1CCC(C)CC1
InChIInChI=1S/C12H24N2O/c1-3-8-13-9-12(15)14-11-6-4-10(2)5-7-11/h10-11,13H,3-9H2,1-2H3,(H,14,15)
InChIKeyPIBFUQAUMLHIAA-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.68
Rot. Bonds5

About N-(4-methylcyclohexyl)-2-(propylamino)acetamide

N-(4-methylcyclohexyl)-2-(propylamino)acetamide (PubChem CID 60671942) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is N-(4-methylcyclohexyl)-2-(propylamino)acetamide.

Molecular Properties

Compound NameN-(4-methylcyclohexyl)-2-(propylamino)acetamide
PubChem CID60671942
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC NameN-(4-methylcyclohexyl)-2-(propylamino)acetamide
SMILESCCCNCC(=O)NC1CCC(C)CC1
InChIInChI=1S/C12H24N2O/c1-3-8-13-9-12(15)14-11-6-4-10(2)5-7-11/h10-11,13H,3-9H2,1-2H3,(H,14,15)
InChIKeyPIBFUQAUMLHIAA-UHFFFAOYSA-N
XLogP1.68
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(1-cyclopropylpiperidin-4-yl)-2-(propylamino)acetamide
CID 60720397
2-(methylamino)-N-(4-methylcyclohexyl)acetamide
CID 24706829
2-(ethylamino)-N-(3-methylcyclopentyl)acetamide
CID 114546128
3-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N-ethylpropanamide
CID 62325687
N-cyclopropyl-2-(propylcarbamoylamino)acetamide
CID 84514772
N-cyclopropyl-4-(propylamino)butanamide
CID 79394678
2-(propylamino)-N-(3,3,5,5-tetramethylcyclohexyl)acetamide
CID 113359647
3-[[2-(cyclopropylamino)-2-oxoethyl]amino]propanoic acid
CID 43466674
N-cyclopropyl-2-(2-methylsulfonylethylamino)acetamide
CID 60915783
N-cyclopropyl-2-(3-hydroxybutylamino)acetamide
CID 64912481
N-cyclohexyl-2-(hexadecylamino)acetamide
CID 54808904
2-[[2-(propylamino)acetyl]amino]cyclopentane-1-carboxylic acid
CID 64813097

Frequently Asked Questions

What is the IUPAC name of N-(4-methylcyclohexyl)-2-(propylamino)acetamide?
The IUPAC name of N-(4-methylcyclohexyl)-2-(propylamino)acetamide (CID 60671942) is N-(4-methylcyclohexyl)-2-(propylamino)acetamide.
What is the SMILES notation for N-(4-methylcyclohexyl)-2-(propylamino)acetamide?
The canonical SMILES for N-(4-methylcyclohexyl)-2-(propylamino)acetamide is CCCNCC(=O)NC1CCC(C)CC1.
What is the InChIKey of N-(4-methylcyclohexyl)-2-(propylamino)acetamide?
The InChIKey is PIBFUQAUMLHIAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-3-8-13-9-12(15)14-11-6-4-10(2)5-7-11/h10-11,13H,3-9H2,1-2H3,(H,14,15).
What are the key properties of N-(4-methylcyclohexyl)-2-(propylamino)acetamide?
N-(4-methylcyclohexyl)-2-(propylamino)acetamide has a molecular weight of 212.34 g/mol, XLogP of 1.68, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylcyclohexyl)-2-(propylamino)acetamide is sourced from PubChem (CID 60671942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).