3-amino-N-(3-cyclohexyloxypropyl)propanamide

C12H24N2O2 — CID 61275390

IUPAC3-amino-N-(3-cyclohexyloxypropyl)propanamide
SMILESNCCC(=O)NCCCOC1CCCCC1
InChIInChI=1S/C12H24N2O2/c13-8-7-12(15)14-9-4-10-16-11-5-2-1-3-6-11/h11H,1-10,13H2,(H,14,15)
InChIKeyWPVYQVWDXKDGRS-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.19
Rot. Bonds7

About 3-amino-N-(3-cyclohexyloxypropyl)propanamide

3-amino-N-(3-cyclohexyloxypropyl)propanamide (PubChem CID 61275390) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 3-amino-N-(3-cyclohexyloxypropyl)propanamide.

Molecular Properties

Compound Name3-amino-N-(3-cyclohexyloxypropyl)propanamide
PubChem CID61275390
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name3-amino-N-(3-cyclohexyloxypropyl)propanamide
SMILESNCCC(=O)NCCCOC1CCCCC1
InChIInChI=1S/C12H24N2O2/c13-8-7-12(15)14-9-4-10-16-11-5-2-1-3-6-11/h11H,1-10,13H2,(H,14,15)
InChIKeyWPVYQVWDXKDGRS-UHFFFAOYSA-N
XLogP1.19
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
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

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-amino-N-(3-cyclohexyloxypropyl)-4,4-dimethylhexanamide
CID 65292212
4-amino-N-(2-cycloheptyloxyethyl)butanamide;hydrochloride
CID 119325380
N-(3-cyclopentyloxypropyl)-4,4,4-trifluorobutanamide
CID 131949460
N-(3-cyclohexyloxypropyl)-3-piperidin-4-ylpropanamide
CID 62210078
1-(aminomethyl)-N-(3-cyclohexyloxypropyl)cyclobutane-1-carboxamide
CID 115448369
4-(4-chlorophenyl)-N-(3-cyclohexyloxypropyl)-4-oxobutanamide
CID 134029986
N-(3-cyclohexyloxypropyl)-2-ethoxyacetamide
CID 60668714
2-amino-N-(3-cyclohexyloxypropyl)propanamide
CID 61275790
N-(3-cyclohexyloxypropyl)-2-(1-hydroxycyclopentyl)acetamide
CID 111430333
N-(3-cyclopentyloxypropyl)-3-(2,6-dichlorophenyl)propanamide
CID 100603333
N-(3-cyclohexyloxypropyl)-3-(2,4-dichlorophenyl)propanamide
CID 100608367
6-amino-N-(2-cyclopentyloxyethyl)-4,4-dimethylhexanamide
CID 65291239

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3-cyclohexyloxypropyl)propanamide?
The IUPAC name of 3-amino-N-(3-cyclohexyloxypropyl)propanamide (CID 61275390) is 3-amino-N-(3-cyclohexyloxypropyl)propanamide.
What is the SMILES notation for 3-amino-N-(3-cyclohexyloxypropyl)propanamide?
The canonical SMILES for 3-amino-N-(3-cyclohexyloxypropyl)propanamide is NCCC(=O)NCCCOC1CCCCC1.
What is the InChIKey of 3-amino-N-(3-cyclohexyloxypropyl)propanamide?
The InChIKey is WPVYQVWDXKDGRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c13-8-7-12(15)14-9-4-10-16-11-5-2-1-3-6-11/h11H,1-10,13H2,(H,14,15).
What are the key properties of 3-amino-N-(3-cyclohexyloxypropyl)propanamide?
3-amino-N-(3-cyclohexyloxypropyl)propanamide has a molecular weight of 228.34 g/mol, XLogP of 1.19, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(3-cyclohexyloxypropyl)propanamide is sourced from PubChem (CID 61275390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).