6-amino-N-(3-cyclohexyloxypropyl)-4,4-dimethylhexanamide

C17H34N2O2 — CID 65292212

IUPAC6-amino-N-(3-cyclohexyloxypropyl)-4,4-dimethylhexanamide
SMILESCC(C)(CCN)CCC(=O)NCCCOC1CCCCC1
InChIInChI=1S/C17H34N2O2/c1-17(2,11-12-18)10-9-16(20)19-13-6-14-21-15-7-4-3-5-8-15/h15H,3-14,18H2,1-2H3,(H,19,20)
InChIKeyOHSVRQLQCOWOBK-UHFFFAOYSA-N
MW298.47 g/mol
LogP3.00
Rot. Bonds10

About 6-amino-N-(3-cyclohexyloxypropyl)-4,4-dimethylhexanamide

6-amino-N-(3-cyclohexyloxypropyl)-4,4-dimethylhexanamide (PubChem CID 65292212) has the molecular formula C17H34N2O2 and a molecular weight of 298.47 g/mol. Its IUPAC name is 6-amino-N-(3-cyclohexyloxypropyl)-4,4-dimethylhexanamide.

Molecular Properties

Compound Name6-amino-N-(3-cyclohexyloxypropyl)-4,4-dimethylhexanamide
PubChem CID65292212
Molecular FormulaC17H34N2O2
Molecular Weight298.47 g/mol
Exact Mass298.26
IUPAC Name6-amino-N-(3-cyclohexyloxypropyl)-4,4-dimethylhexanamide
SMILESCC(C)(CCN)CCC(=O)NCCCOC1CCCCC1
InChIInChI=1S/C17H34N2O2/c1-17(2,11-12-18)10-9-16(20)19-13-6-14-21-15-7-4-3-5-8-15/h15H,3-14,18H2,1-2H3,(H,19,20)
InChIKeyOHSVRQLQCOWOBK-UHFFFAOYSA-N
XLogP3.00
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.47
LogP ≤ 53.00
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-(2-cyclopentyloxyethyl)-4,4-dimethylhexanamide
CID 65291239
3-amino-N-(3-cyclohexyloxypropyl)propanamide
CID 61275390
N-(3-cyclopentyloxypropyl)-4,4,4-trifluorobutanamide
CID 131949460
N-(3-cyclohexyloxypropyl)-3-piperidin-4-ylpropanamide
CID 62210078
4-amino-N-(2-cycloheptyloxyethyl)butanamide;hydrochloride
CID 119325380
6-amino-N-(6-hydroxyhexyl)-4,4-dimethylhexanamide
CID 107842588
6-amino-N-[4-(cyclopropylamino)-4-oxobutyl]-4,4-dimethylhexanamide
CID 79401305
6-amino-4,4-dimethyl-N-(7-methyloctyl)hexanamide
CID 65292309
cycloheptyl 6-amino-4,4-dimethylhexanoate
CID 65285477
N-(3-cyclohexyloxypropyl)-2-ethoxyacetamide
CID 60668714
2-amino-N-(3-cyclohexyloxypropyl)propanamide
CID 61275790
3-(3-cyclohexyloxypropylcarbamoylamino)-2,2-dimethylpropanamide
CID 56814193

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(3-cyclohexyloxypropyl)-4,4-dimethylhexanamide?
The IUPAC name of 6-amino-N-(3-cyclohexyloxypropyl)-4,4-dimethylhexanamide (CID 65292212) is 6-amino-N-(3-cyclohexyloxypropyl)-4,4-dimethylhexanamide.
What is the SMILES notation for 6-amino-N-(3-cyclohexyloxypropyl)-4,4-dimethylhexanamide?
The canonical SMILES for 6-amino-N-(3-cyclohexyloxypropyl)-4,4-dimethylhexanamide is CC(C)(CCN)CCC(=O)NCCCOC1CCCCC1.
What is the InChIKey of 6-amino-N-(3-cyclohexyloxypropyl)-4,4-dimethylhexanamide?
The InChIKey is OHSVRQLQCOWOBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O2/c1-17(2,11-12-18)10-9-16(20)19-13-6-14-21-15-7-4-3-5-8-15/h15H,3-14,18H2,1-2H3,(H,19,20).
What are the key properties of 6-amino-N-(3-cyclohexyloxypropyl)-4,4-dimethylhexanamide?
6-amino-N-(3-cyclohexyloxypropyl)-4,4-dimethylhexanamide has a molecular weight of 298.47 g/mol, XLogP of 3.00, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(3-cyclohexyloxypropyl)-4,4-dimethylhexanamide is sourced from PubChem (CID 65292212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).