3-N-(3-amino-2,2-dimethylpropyl)-3-N-methyl-1-N-(2-methylpropyl)piperidine-1,3-dicarboxamide

C17H34N4O2 — CID 119654700

IUPAC3-N-(3-amino-2,2-dimethylpropyl)-3-N-methyl-1-N-(2-methylpropyl)piperidine-1,3-dicarboxamide
SMILESCC(C)CNC(=O)N1CCCC(C(=O)N(C)CC(C)(C)CN)C1
InChIInChI=1S/C17H34N4O2/c1-13(2)9-19-16(23)21-8-6-7-14(10-21)15(22)20(5)12-17(3,4)11-18/h13-14H,6-12,18H2,1-5H3,(H,19,23)
InChIKeyDOIKAVFZIUYOEQ-UHFFFAOYSA-N
MW326.49 g/mol
LogP1.51
Rot. Bonds6

About 3-N-(3-amino-2,2-dimethylpropyl)-3-N-methyl-1-N-(2-methylpropyl)piperidine-1,3-dicarboxamide

3-N-(3-amino-2,2-dimethylpropyl)-3-N-methyl-1-N-(2-methylpropyl)piperidine-1,3-dicarboxamide (PubChem CID 119654700) has the molecular formula C17H34N4O2 and a molecular weight of 326.49 g/mol. Its IUPAC name is 3-N-(3-amino-2,2-dimethylpropyl)-3-N-methyl-1-N-(2-methylpropyl)piperidine-1,3-dicarboxamide.

Molecular Properties

Compound Name3-N-(3-amino-2,2-dimethylpropyl)-3-N-methyl-1-N-(2-methylpropyl)piperidine-1,3-dicarboxamide
PubChem CID119654700
Molecular FormulaC17H34N4O2
Molecular Weight326.49 g/mol
Exact Mass326.27
IUPAC Name3-N-(3-amino-2,2-dimethylpropyl)-3-N-methyl-1-N-(2-methylpropyl)piperidine-1,3-dicarboxamide
SMILESCC(C)CNC(=O)N1CCCC(C(=O)N(C)CC(C)(C)CN)C1
InChIInChI=1S/C17H34N4O2/c1-13(2)9-19-16(23)21-8-6-7-14(10-21)15(22)20(5)12-17(3,4)11-18/h13-14H,6-12,18H2,1-5H3,(H,19,23)
InChIKeyDOIKAVFZIUYOEQ-UHFFFAOYSA-N
XLogP1.51
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.49
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-N-(3-amino-2,2-dimethylpropyl)-3-N-methyl-1-N-(2-methylpropyl)piperidine-1,3-dicarboxamide with MolForge

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Related Compounds

N-(3-amino-2,2-dimethylpropyl)-N-methyl-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide
CID 119656331
1-acetyl-N-(3-amino-2,2-dimethylpropyl)-N-methylpiperidine-3-carboxamide
CID 119653194
2-[methyl-[1-(2-methylpropylcarbamoyl)piperidine-3-carbonyl]amino]propanoic acid
CID 119208888
(3R)-1-(2-methylpropylcarbamoyl)piperidine-3-carboxylic acid
CID 28511990
3-N-methyl-1-N-(2-methylpropyl)-3-N-piperidin-4-ylpiperidine-1,3-dicarboxamide;hydrochloride
CID 119442831
N-(2-aminoethyl)-1-[1-(2-methylpropylcarbamoyl)piperidine-3-carbonyl]piperidine-3-carboxamide
CID 119480787
3-N-cyclooctyl-1-N-(2-methylpropyl)piperidine-1,3-dicarboxamide
CID 166212919
N-(3-amino-2,2-dimethylpropyl)-1-[2-(difluoromethoxy)benzoyl]-N-methylpiperidine-3-carboxamide;hydrochloride
CID 119652684
3-[4-(methylamino)piperidine-1-carbonyl]-N-(2-methylpropyl)piperidine-1-carboxamide
CID 119561872
(2R)-2-[[1-(2-methylpropylcarbamoyl)piperidine-3-carbonyl]amino]propanoic acid
CID 119243904
3-[3-(1-aminoethyl)piperidine-1-carbonyl]-N-(2-methylpropyl)piperidine-1-carboxamide;hydrochloride
CID 119594752
N-(3-amino-2,2-dimethylpropyl)-N-methylpyrrolidine-1-carboxamide
CID 79652128

Frequently Asked Questions

What is the IUPAC name of 3-N-(3-amino-2,2-dimethylpropyl)-3-N-methyl-1-N-(2-methylpropyl)piperidine-1,3-dicarboxamide?
The IUPAC name of 3-N-(3-amino-2,2-dimethylpropyl)-3-N-methyl-1-N-(2-methylpropyl)piperidine-1,3-dicarboxamide (CID 119654700) is 3-N-(3-amino-2,2-dimethylpropyl)-3-N-methyl-1-N-(2-methylpropyl)piperidine-1,3-dicarboxamide.
What is the SMILES notation for 3-N-(3-amino-2,2-dimethylpropyl)-3-N-methyl-1-N-(2-methylpropyl)piperidine-1,3-dicarboxamide?
The canonical SMILES for 3-N-(3-amino-2,2-dimethylpropyl)-3-N-methyl-1-N-(2-methylpropyl)piperidine-1,3-dicarboxamide is CC(C)CNC(=O)N1CCCC(C(=O)N(C)CC(C)(C)CN)C1.
What is the InChIKey of 3-N-(3-amino-2,2-dimethylpropyl)-3-N-methyl-1-N-(2-methylpropyl)piperidine-1,3-dicarboxamide?
The InChIKey is DOIKAVFZIUYOEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N4O2/c1-13(2)9-19-16(23)21-8-6-7-14(10-21)15(22)20(5)12-17(3,4)11-18/h13-14H,6-12,18H2,1-5H3,(H,19,23).
What are the key properties of 3-N-(3-amino-2,2-dimethylpropyl)-3-N-methyl-1-N-(2-methylpropyl)piperidine-1,3-dicarboxamide?
3-N-(3-amino-2,2-dimethylpropyl)-3-N-methyl-1-N-(2-methylpropyl)piperidine-1,3-dicarboxamide has a molecular weight of 326.49 g/mol, XLogP of 1.51, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(3-amino-2,2-dimethylpropyl)-3-N-methyl-1-N-(2-methylpropyl)piperidine-1,3-dicarboxamide is sourced from PubChem (CID 119654700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).