6-amino-N-(1-ethylpiperidin-3-yl)-4,4-dimethylhexanamide

C15H31N3O — CID 65292402

IUPAC6-amino-N-(1-ethylpiperidin-3-yl)-4,4-dimethylhexanamide
SMILESCCN1CCCC(NC(=O)CCC(C)(C)CCN)C1
InChIInChI=1S/C15H31N3O/c1-4-18-11-5-6-13(12-18)17-14(19)7-8-15(2,3)9-10-16/h13H,4-12,16H2,1-3H3,(H,17,19)
InChIKeyOCPMPABJEDOPQD-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.74
Rot. Bonds7

About 6-amino-N-(1-ethylpiperidin-3-yl)-4,4-dimethylhexanamide

6-amino-N-(1-ethylpiperidin-3-yl)-4,4-dimethylhexanamide (PubChem CID 65292402) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is 6-amino-N-(1-ethylpiperidin-3-yl)-4,4-dimethylhexanamide.

Molecular Properties

Compound Name6-amino-N-(1-ethylpiperidin-3-yl)-4,4-dimethylhexanamide
PubChem CID65292402
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name6-amino-N-(1-ethylpiperidin-3-yl)-4,4-dimethylhexanamide
SMILESCCN1CCCC(NC(=O)CCC(C)(C)CCN)C1
InChIInChI=1S/C15H31N3O/c1-4-18-11-5-6-13(12-18)17-14(19)7-8-15(2,3)9-10-16/h13H,4-12,16H2,1-3H3,(H,17,19)
InChIKeyOCPMPABJEDOPQD-UHFFFAOYSA-N
XLogP1.74
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(1-ethylpiperidin-3-yl)-3-methylbutanamide
CID 64677785
N-(1-ethylpiperidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112605280
6-amino-4,4-dimethyl-N-(oxan-3-yl)hexanamide
CID 65291525
2-[1-(aminomethyl)cyclohexyl]-N-(1-ethylpiperidin-3-yl)acetamide
CID 104677930
1-cyclopropyl-3-(1-ethylpiperidin-3-yl)urea
CID 115589816
1-cyclopentyl-3-(1-ethylpiperidin-3-yl)urea
CID 115589989
6-amino-4,4-dimethyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)hexanamide
CID 65472003
N-(1-ethylpiperidin-3-yl)-2-(4-sulfanylphenyl)acetamide
CID 107025229
4-[(6-amino-4,4-dimethylhexanoyl)amino]cyclohexane-1-carboxamide
CID 65290886
5-[(1-ethylpiperidin-3-yl)carbamoylamino]-5-oxopentanoic acid
CID 61478336
6-amino-4,4-dimethyl-N-(thiolan-3-yl)hexanamide
CID 103063106
cis-(1R,3S)-3-[(6-amino-4,4-dimethylhexanoyl)amino]cyclopentane-1-carboxylic acid
CID 106322969

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(1-ethylpiperidin-3-yl)-4,4-dimethylhexanamide?
The IUPAC name of 6-amino-N-(1-ethylpiperidin-3-yl)-4,4-dimethylhexanamide (CID 65292402) is 6-amino-N-(1-ethylpiperidin-3-yl)-4,4-dimethylhexanamide.
What is the SMILES notation for 6-amino-N-(1-ethylpiperidin-3-yl)-4,4-dimethylhexanamide?
The canonical SMILES for 6-amino-N-(1-ethylpiperidin-3-yl)-4,4-dimethylhexanamide is CCN1CCCC(NC(=O)CCC(C)(C)CCN)C1.
What is the InChIKey of 6-amino-N-(1-ethylpiperidin-3-yl)-4,4-dimethylhexanamide?
The InChIKey is OCPMPABJEDOPQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-4-18-11-5-6-13(12-18)17-14(19)7-8-15(2,3)9-10-16/h13H,4-12,16H2,1-3H3,(H,17,19).
What are the key properties of 6-amino-N-(1-ethylpiperidin-3-yl)-4,4-dimethylhexanamide?
6-amino-N-(1-ethylpiperidin-3-yl)-4,4-dimethylhexanamide has a molecular weight of 269.43 g/mol, XLogP of 1.74, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(1-ethylpiperidin-3-yl)-4,4-dimethylhexanamide is sourced from PubChem (CID 65292402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).