1-(6-amino-4,4-dimethylhexanoyl)piperidine-3-carboxamide

C14H27N3O2 — CID 65292570

IUPAC1-(6-amino-4,4-dimethylhexanoyl)piperidine-3-carboxamide
SMILESCC(C)(CCN)CCC(=O)N1CCCC(C(N)=O)C1
InChIInChI=1S/C14H27N3O2/c1-14(2,7-8-15)6-5-12(18)17-9-3-4-11(10-17)13(16)19/h11H,3-10,15H2,1-2H3,(H2,16,19)
InChIKeyPBYYMSSTEVVUBD-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.87
Rot. Bonds6

About 1-(6-amino-4,4-dimethylhexanoyl)piperidine-3-carboxamide

1-(6-amino-4,4-dimethylhexanoyl)piperidine-3-carboxamide (PubChem CID 65292570) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 1-(6-amino-4,4-dimethylhexanoyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(6-amino-4,4-dimethylhexanoyl)piperidine-3-carboxamide
PubChem CID65292570
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name1-(6-amino-4,4-dimethylhexanoyl)piperidine-3-carboxamide
SMILESCC(C)(CCN)CCC(=O)N1CCCC(C(N)=O)C1
InChIInChI=1S/C14H27N3O2/c1-14(2,7-8-15)6-5-12(18)17-9-3-4-11(10-17)13(16)19/h11H,3-10,15H2,1-2H3,(H2,16,19)
InChIKeyPBYYMSSTEVVUBD-UHFFFAOYSA-N
XLogP0.87
TPSA89.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-1-[(3S)-3-hydroxypiperidin-1-yl]-4,4-dimethylhexan-1-one
CID 107222893
tert-butyl 4-(3-carbamoylpiperidin-1-yl)-4-oxobutanoate
CID 106706926
1-(3-chloropropanoyl)piperidine-3-carboxamide
CID 16785427
6-amino-4,4-dimethyl-1-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)hexan-1-one
CID 81199855
6-amino-1-(4-hydroxypiperidin-1-yl)-4,4-dimethylhexan-1-one
CID 65293101
methyl 3-(3-carbamoylpiperidin-1-yl)-3-oxopropanoate
CID 134069304
6-amino-4,4-dimethyl-1-(1,4-oxazepan-4-yl)hexan-1-one
CID 65291131
(3R)-1-(2-chloroacetyl)piperidine-3-carboxamide
CID 9115268
(3R)-1-[2-[(1-cycloheptyl-2-methylpropan-2-yl)amino]acetyl]piperidine-3-carboxamide
CID 99778459
6-amino-1-(2,6-dimethylmorpholin-4-yl)-4,4-dimethylhexan-1-one
CID 65293281
1-(3-aminopropanoyl)-N-pentan-2-ylpiperidine-3-carboxamide;hydrochloride
CID 119311679
4-(6-amino-4,4-dimethylhexanoyl)-N-ethylpiperazine-1-carboxamide
CID 65290869

Frequently Asked Questions

What is the IUPAC name of 1-(6-amino-4,4-dimethylhexanoyl)piperidine-3-carboxamide?
The IUPAC name of 1-(6-amino-4,4-dimethylhexanoyl)piperidine-3-carboxamide (CID 65292570) is 1-(6-amino-4,4-dimethylhexanoyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(6-amino-4,4-dimethylhexanoyl)piperidine-3-carboxamide?
The canonical SMILES for 1-(6-amino-4,4-dimethylhexanoyl)piperidine-3-carboxamide is CC(C)(CCN)CCC(=O)N1CCCC(C(N)=O)C1.
What is the InChIKey of 1-(6-amino-4,4-dimethylhexanoyl)piperidine-3-carboxamide?
The InChIKey is PBYYMSSTEVVUBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-14(2,7-8-15)6-5-12(18)17-9-3-4-11(10-17)13(16)19/h11H,3-10,15H2,1-2H3,(H2,16,19).
What are the key properties of 1-(6-amino-4,4-dimethylhexanoyl)piperidine-3-carboxamide?
1-(6-amino-4,4-dimethylhexanoyl)piperidine-3-carboxamide has a molecular weight of 269.39 g/mol, XLogP of 0.87, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-amino-4,4-dimethylhexanoyl)piperidine-3-carboxamide is sourced from PubChem (CID 65292570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).