2-cyclohexyl-N-[2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-2-oxoethyl]acetamide

C16H30N2O3 — CID 111596150

IUPAC2-cyclohexyl-N-[2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-2-oxoethyl]acetamide
SMILESCCN(CC(C)(C)O)C(=O)CNC(=O)CC1CCCCC1
InChIInChI=1S/C16H30N2O3/c1-4-18(12-16(2,3)21)15(20)11-17-14(19)10-13-8-6-5-7-9-13/h13,21H,4-12H2,1-3H3,(H,17,19)
InChIKeyHZELQCQPEGBCFH-UHFFFAOYSA-N
MW298.43 g/mol
LogP1.69
Rot. Bonds7

About 2-cyclohexyl-N-[2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-2-oxoethyl]acetamide

2-cyclohexyl-N-[2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-2-oxoethyl]acetamide (PubChem CID 111596150) has the molecular formula C16H30N2O3 and a molecular weight of 298.43 g/mol. Its IUPAC name is 2-cyclohexyl-N-[2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-cyclohexyl-N-[2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-2-oxoethyl]acetamide
PubChem CID111596150
Molecular FormulaC16H30N2O3
Molecular Weight298.43 g/mol
Exact Mass298.23
IUPAC Name2-cyclohexyl-N-[2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-2-oxoethyl]acetamide
SMILESCCN(CC(C)(C)O)C(=O)CNC(=O)CC1CCCCC1
InChIInChI=1S/C16H30N2O3/c1-4-18(12-16(2,3)21)15(20)11-17-14(19)10-13-8-6-5-7-9-13/h13,21H,4-12H2,1-3H3,(H,17,19)
InChIKeyHZELQCQPEGBCFH-UHFFFAOYSA-N
XLogP1.69
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cycloheptylmethylamino)-N,N-diethylacetamide
CID 113253458
methyl 2-[(2-cyclohexylacetyl)amino]acetate
CID 43404765
3-cyclohexyl-1-ethyl-1-(2-hydroxy-2-methylpropyl)urea
CID 79386772
3-[ethyl-(2-hydroxy-2-methylpropyl)amino]-3-oxopropanoic acid
CID 79385431
2-cycloheptyl-N-(2-ethyl-2-hydroxybutyl)acetamide
CID 115681303
2-[[2-[(2-cyclohexylacetyl)amino]acetyl]amino]-2-methylbutanoic acid
CID 119199192
2-cyclobutyl-N-(3,3-dimethyl-2-oxobutyl)acetamide
CID 103867639
2-amino-N-[2-[cyclobutylmethyl(ethyl)amino]-2-oxoethyl]acetamide
CID 107398419
2-[benzyl-[2-[(2-cyclohexylacetyl)amino]acetyl]amino]acetic acid
CID 119196837
2-cyclohexyl-N-[2-[4-(ethylaminomethyl)piperidin-1-yl]-2-oxoethyl]acetamide
CID 119645034
2-cycloheptyl-N-(2-hydroxy-2,4-dimethylpentyl)acetamide
CID 114458366
2-[[2-[(2-cyclopentylacetyl)amino]acetyl]amino]acetic acid
CID 60657329

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-[2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-2-oxoethyl]acetamide?
The IUPAC name of 2-cyclohexyl-N-[2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-2-oxoethyl]acetamide (CID 111596150) is 2-cyclohexyl-N-[2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-2-oxoethyl]acetamide.
What is the SMILES notation for 2-cyclohexyl-N-[2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-2-oxoethyl]acetamide?
The canonical SMILES for 2-cyclohexyl-N-[2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-2-oxoethyl]acetamide is CCN(CC(C)(C)O)C(=O)CNC(=O)CC1CCCCC1.
What is the InChIKey of 2-cyclohexyl-N-[2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-2-oxoethyl]acetamide?
The InChIKey is HZELQCQPEGBCFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O3/c1-4-18(12-16(2,3)21)15(20)11-17-14(19)10-13-8-6-5-7-9-13/h13,21H,4-12H2,1-3H3,(H,17,19).
What are the key properties of 2-cyclohexyl-N-[2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-2-oxoethyl]acetamide?
2-cyclohexyl-N-[2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-2-oxoethyl]acetamide has a molecular weight of 298.43 g/mol, XLogP of 1.69, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-[2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-2-oxoethyl]acetamide is sourced from PubChem (CID 111596150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).