2-(1-cyclohexylethylamino)-N-pentan-2-ylacetamide

C15H30N2O — CID 62406812

IUPAC2-(1-cyclohexylethylamino)-N-pentan-2-ylacetamide
SMILESCCCC(C)NC(=O)CNC(C)C1CCCCC1
InChIInChI=1S/C15H30N2O/c1-4-8-12(2)17-15(18)11-16-13(3)14-9-6-5-7-10-14/h12-14,16H,4-11H2,1-3H3,(H,17,18)
InChIKeyXCTBBZCZIAQWHN-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.85
Rot. Bonds7

About 2-(1-cyclohexylethylamino)-N-pentan-2-ylacetamide

2-(1-cyclohexylethylamino)-N-pentan-2-ylacetamide (PubChem CID 62406812) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 2-(1-cyclohexylethylamino)-N-pentan-2-ylacetamide.

Molecular Properties

Compound Name2-(1-cyclohexylethylamino)-N-pentan-2-ylacetamide
PubChem CID62406812
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name2-(1-cyclohexylethylamino)-N-pentan-2-ylacetamide
SMILESCCCC(C)NC(=O)CNC(C)C1CCCCC1
InChIInChI=1S/C15H30N2O/c1-4-8-12(2)17-15(18)11-16-13(3)14-9-6-5-7-10-14/h12-14,16H,4-11H2,1-3H3,(H,17,18)
InChIKeyXCTBBZCZIAQWHN-UHFFFAOYSA-N
XLogP2.85
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(oxan-4-yl)ethylamino]-N-pentan-2-ylacetamide
CID 103914830
2-(cycloheptylamino)-N-pentan-2-ylacetamide
CID 60688089
2-(cyclohexylamino)-N-pentan-2-ylacetamide
CID 60683795
N-butyl-2-[[(1R)-1-cyclohexylethyl]amino]acetamide
CID 81384625
2-[[(1S)-1-cyclopentylethyl]amino]-N-(1-methoxypropan-2-yl)acetamide
CID 81394863
2-[[(1R)-1-cycloheptylethyl]amino]-N-propylacetamide
CID 81393570
2-[[(1R)-1-cyclohexylethyl]amino]-N-ethylacetamide
CID 81385685
2-(cyclohexylmethylamino)-N-pentan-2-ylacetamide
CID 60687215
N-carbamoyl-2-[[(1R)-1-cycloheptylethyl]amino]acetamide
CID 81393673
N-tert-butyl-2-[[(1R)-1-cycloheptylethyl]amino]acetamide
CID 81393192
2-(1-cyclopropylethylamino)-N-(1-methoxypropan-2-yl)acetamide
CID 60696176
N-[(1S)-1-cycloheptylethyl]-2-(propylamino)acetamide
CID 81393460

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclohexylethylamino)-N-pentan-2-ylacetamide?
The IUPAC name of 2-(1-cyclohexylethylamino)-N-pentan-2-ylacetamide (CID 62406812) is 2-(1-cyclohexylethylamino)-N-pentan-2-ylacetamide.
What is the SMILES notation for 2-(1-cyclohexylethylamino)-N-pentan-2-ylacetamide?
The canonical SMILES for 2-(1-cyclohexylethylamino)-N-pentan-2-ylacetamide is CCCC(C)NC(=O)CNC(C)C1CCCCC1.
What is the InChIKey of 2-(1-cyclohexylethylamino)-N-pentan-2-ylacetamide?
The InChIKey is XCTBBZCZIAQWHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-4-8-12(2)17-15(18)11-16-13(3)14-9-6-5-7-10-14/h12-14,16H,4-11H2,1-3H3,(H,17,18).
What are the key properties of 2-(1-cyclohexylethylamino)-N-pentan-2-ylacetamide?
2-(1-cyclohexylethylamino)-N-pentan-2-ylacetamide has a molecular weight of 254.42 g/mol, XLogP of 2.85, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclohexylethylamino)-N-pentan-2-ylacetamide is sourced from PubChem (CID 62406812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).