1-(6-amino-5,5-dimethylhexyl)piperidine-3-carboxamide

C14H29N3O — CID 106707851

IUPAC1-(6-amino-5,5-dimethylhexyl)piperidine-3-carboxamide
SMILESCC(C)(CN)CCCCN1CCCC(C(N)=O)C1
InChIInChI=1S/C14H29N3O/c1-14(2,11-15)7-3-4-8-17-9-5-6-12(10-17)13(16)18/h12H,3-11,15H2,1-2H3,(H2,16,18)
InChIKeyDOECOEJQTDTTQA-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.34
Rot. Bonds7

About 1-(6-amino-5,5-dimethylhexyl)piperidine-3-carboxamide

1-(6-amino-5,5-dimethylhexyl)piperidine-3-carboxamide (PubChem CID 106707851) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 1-(6-amino-5,5-dimethylhexyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(6-amino-5,5-dimethylhexyl)piperidine-3-carboxamide
PubChem CID106707851
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name1-(6-amino-5,5-dimethylhexyl)piperidine-3-carboxamide
SMILESCC(C)(CN)CCCCN1CCCC(C(N)=O)C1
InChIInChI=1S/C14H29N3O/c1-14(2,11-15)7-3-4-8-17-9-5-6-12(10-17)13(16)18/h12H,3-11,15H2,1-2H3,(H2,16,18)
InChIKeyDOECOEJQTDTTQA-UHFFFAOYSA-N
XLogP1.34
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.34
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

(3S)-1-dodecylpiperidine-3-carboxamide
CID 98141559
1-(3-bromopropyl)piperidine-3-carboxamide
CID 61287309
2,2-dimethyl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)hexan-1-amine
CID 106708095
1-[3-(methylamino)propyl]piperidine-3-carboxamide
CID 61386237
1-(6-amino-5,5-dimethylhexyl)-3-methylpiperidin-4-ol
CID 106708252
(3R)-1-(2,2-dimethylpropyl)piperidine-3-carboxamide
CID 58877777
1-(2,2-dimethylpropyl)piperidine-3-carboxamide
CID 21060232
2,2-dimethyl-6-(4-methylazepan-1-yl)hexan-1-amine
CID 106708126
1-(2-chloroethyl)piperidine-3-carboxamide
CID 61287310
1-[6-(hydroxyamino)-6-oxohexyl]piperidine-3-carboxamide
CID 175801868
1-(2-hydroxy-2,3-dimethylbutyl)piperidine-3-carboxamide
CID 114447589
1-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 42950662

Frequently Asked Questions

What is the IUPAC name of 1-(6-amino-5,5-dimethylhexyl)piperidine-3-carboxamide?
The IUPAC name of 1-(6-amino-5,5-dimethylhexyl)piperidine-3-carboxamide (CID 106707851) is 1-(6-amino-5,5-dimethylhexyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(6-amino-5,5-dimethylhexyl)piperidine-3-carboxamide?
The canonical SMILES for 1-(6-amino-5,5-dimethylhexyl)piperidine-3-carboxamide is CC(C)(CN)CCCCN1CCCC(C(N)=O)C1.
What is the InChIKey of 1-(6-amino-5,5-dimethylhexyl)piperidine-3-carboxamide?
The InChIKey is DOECOEJQTDTTQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-14(2,11-15)7-3-4-8-17-9-5-6-12(10-17)13(16)18/h12H,3-11,15H2,1-2H3,(H2,16,18).
What are the key properties of 1-(6-amino-5,5-dimethylhexyl)piperidine-3-carboxamide?
1-(6-amino-5,5-dimethylhexyl)piperidine-3-carboxamide has a molecular weight of 255.41 g/mol, XLogP of 1.34, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-amino-5,5-dimethylhexyl)piperidine-3-carboxamide is sourced from PubChem (CID 106707851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).