2-(butan-2-ylamino)-N-(4-hydroxycyclohexyl)acetamide

C12H24N2O2 — CID 60852285

IUPAC2-(butan-2-ylamino)-N-(4-hydroxycyclohexyl)acetamide
SMILESCCC(C)NCC(=O)NC1CCC(O)CC1
InChIInChI=1S/C12H24N2O2/c1-3-9(2)13-8-12(16)14-10-4-6-11(15)7-5-10/h9-11,13,15H,3-8H2,1-2H3,(H,14,16)
InChIKeyNRIKNOPOEAIWEU-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.79
Rot. Bonds5

About 2-(butan-2-ylamino)-N-(4-hydroxycyclohexyl)acetamide

2-(butan-2-ylamino)-N-(4-hydroxycyclohexyl)acetamide (PubChem CID 60852285) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-(butan-2-ylamino)-N-(4-hydroxycyclohexyl)acetamide.

Molecular Properties

Compound Name2-(butan-2-ylamino)-N-(4-hydroxycyclohexyl)acetamide
PubChem CID60852285
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-(butan-2-ylamino)-N-(4-hydroxycyclohexyl)acetamide
SMILESCCC(C)NCC(=O)NC1CCC(O)CC1
InChIInChI=1S/C12H24N2O2/c1-3-9(2)13-8-12(16)14-10-4-6-11(15)7-5-10/h9-11,13,15H,3-8H2,1-2H3,(H,14,16)
InChIKeyNRIKNOPOEAIWEU-UHFFFAOYSA-N
XLogP0.79
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(butan-2-ylamino)-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]acetamide
CID 60853761
[4-[[2-(butan-2-ylamino)acetyl]amino]cyclohexyl] 2-methylprop-2-enoate
CID 145388941
2-(butan-2-ylamino)-N-(oxolan-3-yl)acetamide
CID 80713915
2-(butan-2-ylamino)-N-(3,3-dimethylcyclopentyl)acetamide
CID 114546344
3-[[2-(butan-2-ylamino)acetyl]amino]cyclohexane-1-carboxylic acid
CID 63043134
2-(butan-2-ylamino)-N-(2-methylcyclopropyl)acetamide
CID 62398768
2-[[2-(cyclopentylamino)-2-oxoethyl]amino]-N-cyclopropylpropanamide
CID 113248238
2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N,N-diethylpropanamide
CID 43420346
2-(butan-2-ylamino)-N-(2,3-dihydro-1H-inden-2-yl)acetamide
CID 114007934
2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-3-methylbutanamide
CID 103914129
N-cycloheptyl-2-(1-hydroxypropan-2-ylamino)acetamide
CID 62573821
N-cyclopentyl-2-(1-pyrrolidin-1-ylpropan-2-ylamino)acetamide
CID 54952745

Frequently Asked Questions

What is the IUPAC name of 2-(butan-2-ylamino)-N-(4-hydroxycyclohexyl)acetamide?
The IUPAC name of 2-(butan-2-ylamino)-N-(4-hydroxycyclohexyl)acetamide (CID 60852285) is 2-(butan-2-ylamino)-N-(4-hydroxycyclohexyl)acetamide.
What is the SMILES notation for 2-(butan-2-ylamino)-N-(4-hydroxycyclohexyl)acetamide?
The canonical SMILES for 2-(butan-2-ylamino)-N-(4-hydroxycyclohexyl)acetamide is CCC(C)NCC(=O)NC1CCC(O)CC1.
What is the InChIKey of 2-(butan-2-ylamino)-N-(4-hydroxycyclohexyl)acetamide?
The InChIKey is NRIKNOPOEAIWEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-3-9(2)13-8-12(16)14-10-4-6-11(15)7-5-10/h9-11,13,15H,3-8H2,1-2H3,(H,14,16).
What are the key properties of 2-(butan-2-ylamino)-N-(4-hydroxycyclohexyl)acetamide?
2-(butan-2-ylamino)-N-(4-hydroxycyclohexyl)acetamide has a molecular weight of 228.34 g/mol, XLogP of 0.79, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(butan-2-ylamino)-N-(4-hydroxycyclohexyl)acetamide is sourced from PubChem (CID 60852285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).