2-[(4-hydroxycyclohexyl)amino]-N-propan-2-ylpropanamide

C12H24N2O2 — CID 103602120

IUPAC2-[(4-hydroxycyclohexyl)amino]-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(C)NC1CCC(O)CC1
InChIInChI=1S/C12H24N2O2/c1-8(2)13-12(16)9(3)14-10-4-6-11(15)7-5-10/h8-11,14-15H,4-7H2,1-3H3,(H,13,16)
InChIKeyQGCGTZHNSVYGPZ-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.79
Rot. Bonds4

About 2-[(4-hydroxycyclohexyl)amino]-N-propan-2-ylpropanamide

2-[(4-hydroxycyclohexyl)amino]-N-propan-2-ylpropanamide (PubChem CID 103602120) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-[(4-hydroxycyclohexyl)amino]-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name2-[(4-hydroxycyclohexyl)amino]-N-propan-2-ylpropanamide
PubChem CID103602120
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-[(4-hydroxycyclohexyl)amino]-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(C)NC1CCC(O)CC1
InChIInChI=1S/C12H24N2O2/c1-8(2)13-12(16)9(3)14-10-4-6-11(15)7-5-10/h8-11,14-15H,4-7H2,1-3H3,(H,13,16)
InChIKeyQGCGTZHNSVYGPZ-UHFFFAOYSA-N
XLogP0.79
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
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

N-cyclopentyl-2-(cyclopropylamino)propanamide
CID 43083564
2-(cyclohexylamino)-N-cyclopentylpropanamide
CID 43083335
N-cyclohexyl-2-(cyclooctylamino)propanamide
CID 43083622
2-(cycloheptylamino)-N-cyclohexylpropanamide
CID 43236394
4-(4-methylpent-1-yn-3-ylamino)cyclohexan-1-ol
CID 130481330
4-(1-cyclobutylethylamino)cyclohexan-1-ol
CID 103775411
(2S)-2-(cyclopropylamino)propanamide
CID 28835909
2-[[2-(hydroxymethyl)cyclohexyl]amino]-N-propan-2-ylpropanamide
CID 106361170
2-[(2-methoxycyclopentyl)amino]-N-propan-2-ylpropanamide
CID 62088226
3-[(4-hydroxycyclohexyl)amino]butanamide
CID 45281355
3-(cyclohexylamino)-2-hydroxy-N-propan-2-ylbutanamide
CID 134349254
2-(2-adamantylamino)-N-cyclopropylpropanamide
CID 78609315

Frequently Asked Questions

What is the IUPAC name of 2-[(4-hydroxycyclohexyl)amino]-N-propan-2-ylpropanamide?
The IUPAC name of 2-[(4-hydroxycyclohexyl)amino]-N-propan-2-ylpropanamide (CID 103602120) is 2-[(4-hydroxycyclohexyl)amino]-N-propan-2-ylpropanamide.
What is the SMILES notation for 2-[(4-hydroxycyclohexyl)amino]-N-propan-2-ylpropanamide?
The canonical SMILES for 2-[(4-hydroxycyclohexyl)amino]-N-propan-2-ylpropanamide is CC(C)NC(=O)C(C)NC1CCC(O)CC1.
What is the InChIKey of 2-[(4-hydroxycyclohexyl)amino]-N-propan-2-ylpropanamide?
The InChIKey is QGCGTZHNSVYGPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-8(2)13-12(16)9(3)14-10-4-6-11(15)7-5-10/h8-11,14-15H,4-7H2,1-3H3,(H,13,16).
What are the key properties of 2-[(4-hydroxycyclohexyl)amino]-N-propan-2-ylpropanamide?
2-[(4-hydroxycyclohexyl)amino]-N-propan-2-ylpropanamide has a molecular weight of 228.34 g/mol, XLogP of 0.79, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-hydroxycyclohexyl)amino]-N-propan-2-ylpropanamide is sourced from PubChem (CID 103602120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).