2-(3-aminocyclohexyl)oxy-N-propan-2-ylpropanamide

C12H24N2O2 — CID 79465179

IUPAC2-(3-aminocyclohexyl)oxy-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(C)OC1CCCC(N)C1
InChIInChI=1S/C12H24N2O2/c1-8(2)14-12(15)9(3)16-11-6-4-5-10(13)7-11/h8-11H,4-7,13H2,1-3H3,(H,14,15)
InChIKeyVWAQIYFJAYOSHG-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.19
Rot. Bonds4

About 2-(3-aminocyclohexyl)oxy-N-propan-2-ylpropanamide

2-(3-aminocyclohexyl)oxy-N-propan-2-ylpropanamide (PubChem CID 79465179) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-(3-aminocyclohexyl)oxy-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name2-(3-aminocyclohexyl)oxy-N-propan-2-ylpropanamide
PubChem CID79465179
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-(3-aminocyclohexyl)oxy-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(C)OC1CCCC(N)C1
InChIInChI=1S/C12H24N2O2/c1-8(2)14-12(15)9(3)16-11-6-4-5-10(13)7-11/h8-11H,4-7,13H2,1-3H3,(H,14,15)
InChIKeyVWAQIYFJAYOSHG-UHFFFAOYSA-N
XLogP1.19
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-aminocyclohexyl)oxy-N-tert-butylpropanamide
CID 79466116
2-(3-aminocyclopentyl)oxy-N-cyclopentylpropanamide
CID 79465685
2-(3-aminocyclopentyl)oxy-N-prop-2-ynylpropanamide
CID 79464943
2-(3-aminocyclopentyl)oxy-N-prop-2-enylpropanamide
CID 79464530
(2S)-N-cycloheptyl-2-[(1R,3R)-3-methylcyclohexyl]oxypropanamide
CID 99808546
(3-aminocyclopentyl) N-propan-2-ylcarbamate
CID 79465230
2-(3-aminocyclohexyl)oxybutanoic acid
CID 106940597
methyl (2S)-2-cyclobutyloxypropanoate
CID 103337973
2-[[(2S)-2-[(1S,3R)-3-methylcyclohexyl]oxypropanoyl]amino]acetic acid
CID 124690180
2-[[(2S)-2-[(1R,3R)-3-methylcyclohexyl]oxypropanoyl]amino]acetic acid
CID 124689895
2-(4-aminocyclohexyl)oxy-N-pentan-3-ylpropanamide
CID 62806864
(2R)-2-[(1R,3R)-3-methylcyclohexyl]oxy-N-[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]propanamide
CID 99104158

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminocyclohexyl)oxy-N-propan-2-ylpropanamide?
The IUPAC name of 2-(3-aminocyclohexyl)oxy-N-propan-2-ylpropanamide (CID 79465179) is 2-(3-aminocyclohexyl)oxy-N-propan-2-ylpropanamide.
What is the SMILES notation for 2-(3-aminocyclohexyl)oxy-N-propan-2-ylpropanamide?
The canonical SMILES for 2-(3-aminocyclohexyl)oxy-N-propan-2-ylpropanamide is CC(C)NC(=O)C(C)OC1CCCC(N)C1.
What is the InChIKey of 2-(3-aminocyclohexyl)oxy-N-propan-2-ylpropanamide?
The InChIKey is VWAQIYFJAYOSHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-8(2)14-12(15)9(3)16-11-6-4-5-10(13)7-11/h8-11H,4-7,13H2,1-3H3,(H,14,15).
What are the key properties of 2-(3-aminocyclohexyl)oxy-N-propan-2-ylpropanamide?
2-(3-aminocyclohexyl)oxy-N-propan-2-ylpropanamide has a molecular weight of 228.34 g/mol, XLogP of 1.19, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminocyclohexyl)oxy-N-propan-2-ylpropanamide is sourced from PubChem (CID 79465179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).