1-(5-amino-4-methylpentanoyl)piperidine-4-carboxamide

C12H23N3O2 — CID 82683543

IUPAC1-(5-amino-4-methylpentanoyl)piperidine-4-carboxamide
SMILESCC(CN)CCC(=O)N1CCC(C(N)=O)CC1
InChIInChI=1S/C12H23N3O2/c1-9(8-13)2-3-11(16)15-6-4-10(5-7-15)12(14)17/h9-10H,2-8,13H2,1H3,(H2,14,17)
InChIKeyVMGJWRQHISZIJJ-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.09
Rot. Bonds5

About 1-(5-amino-4-methylpentanoyl)piperidine-4-carboxamide

1-(5-amino-4-methylpentanoyl)piperidine-4-carboxamide (PubChem CID 82683543) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 1-(5-amino-4-methylpentanoyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(5-amino-4-methylpentanoyl)piperidine-4-carboxamide
PubChem CID82683543
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name1-(5-amino-4-methylpentanoyl)piperidine-4-carboxamide
SMILESCC(CN)CCC(=O)N1CCC(C(N)=O)CC1
InChIInChI=1S/C12H23N3O2/c1-9(8-13)2-3-11(16)15-6-4-10(5-7-15)12(14)17/h9-10H,2-8,13H2,1H3,(H2,14,17)
InChIKeyVMGJWRQHISZIJJ-UHFFFAOYSA-N
XLogP0.09
TPSA89.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-amino-4-methylpentanoyl)pyrrolidine-3-carboxylic acid
CID 82012551
5-amino-1-[4-(hydroxymethyl)piperidin-1-yl]-4-methylpentan-1-one
CID 82684034
5-amino-1-(4-methoxypiperidin-1-yl)-4-methylpentan-1-one
CID 82017222
5-amino-1-(3-hydroxypyrrolidin-1-yl)-4-methylpentan-1-one
CID 82011405
5-amino-4-methyl-1-(4-methylazepan-1-yl)pentan-1-one
CID 82689210
5-amino-1-(4-ethoxypiperidin-1-yl)-4-methylpentan-1-one
CID 82010948
N-[1-(5-amino-4-methylpentanoyl)piperidin-4-yl]-2-methylpropanamide
CID 82011596
5-amino-4-methyl-1-[4-(3-methylbutanoyl)piperazin-1-yl]pentan-1-one
CID 82011875
5-amino-1-[(3S)-3-hydroxypiperidin-1-yl]-4-methylpentan-1-one
CID 107222947
4-(4-carbamoylpiperidin-1-yl)-4-oxobutanoic acid
CID 2826389
1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide
CID 119137408
5-amino-1-[4-(2-hydroxyethyl)piperazin-1-yl]-4-methylpentan-1-one
CID 82683408

Frequently Asked Questions

What is the IUPAC name of 1-(5-amino-4-methylpentanoyl)piperidine-4-carboxamide?
The IUPAC name of 1-(5-amino-4-methylpentanoyl)piperidine-4-carboxamide (CID 82683543) is 1-(5-amino-4-methylpentanoyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(5-amino-4-methylpentanoyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(5-amino-4-methylpentanoyl)piperidine-4-carboxamide is CC(CN)CCC(=O)N1CCC(C(N)=O)CC1.
What is the InChIKey of 1-(5-amino-4-methylpentanoyl)piperidine-4-carboxamide?
The InChIKey is VMGJWRQHISZIJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-9(8-13)2-3-11(16)15-6-4-10(5-7-15)12(14)17/h9-10H,2-8,13H2,1H3,(H2,14,17).
What are the key properties of 1-(5-amino-4-methylpentanoyl)piperidine-4-carboxamide?
1-(5-amino-4-methylpentanoyl)piperidine-4-carboxamide has a molecular weight of 241.33 g/mol, XLogP of 0.09, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-amino-4-methylpentanoyl)piperidine-4-carboxamide is sourced from PubChem (CID 82683543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).