N-(1-aminopentan-3-yl)hexanamide

C11H24N2O — CID 62652516

IUPACN-(1-aminopentan-3-yl)hexanamide
SMILESCCCCCC(=O)NC(CC)CCN
InChIInChI=1S/C11H24N2O/c1-3-5-6-7-11(14)13-10(4-2)8-9-12/h10H,3-9,12H2,1-2H3,(H,13,14)
InChIKeyDXBJMTYSGDVOHD-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.81
Rot. Bonds8

About N-(1-aminopentan-3-yl)hexanamide

N-(1-aminopentan-3-yl)hexanamide (PubChem CID 62652516) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is N-(1-aminopentan-3-yl)hexanamide.

Molecular Properties

Compound NameN-(1-aminopentan-3-yl)hexanamide
PubChem CID62652516
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC NameN-(1-aminopentan-3-yl)hexanamide
SMILESCCCCCC(=O)NC(CC)CCN
InChIInChI=1S/C11H24N2O/c1-3-5-6-7-11(14)13-10(4-2)8-9-12/h10H,3-9,12H2,1-2H3,(H,13,14)
InChIKeyDXBJMTYSGDVOHD-UHFFFAOYSA-N
XLogP1.81
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-pentan-3-yldocosanamide
CID 123339332
7-amino-N-hexan-3-ylheptanamide;hydrochloride
CID 119757664
N-(4-aminobutan-2-yl)octanamide
CID 62087208
N-[(2S)-1-hydroxybutan-2-yl]hexanamide
CID 104981701
N'-octan-3-ylbutanediamide
CID 82041118
N-(1-amino-1-sulfanylidenepentan-3-yl)hexanamide
CID 62651450
N-[(2R)-1,4-diamino-1-oxobutan-2-yl]decanamide
CID 142575651
N-(4-amino-1-oxobutan-2-yl)octanamide;methanamine
CID 145435395
N-[4-amino-1-(octadecanoylamino)butyl]octadecanamide
CID 141044961
5-amino-N-pentan-3-ylhexanamide
CID 82848944
N-(6-aminohexan-2-yl)octanamide
CID 123172105
8-amino-N-[1-(8-aminooctanoylamino)octyl]octanamide
CID 18787747

Frequently Asked Questions

What is the IUPAC name of N-(1-aminopentan-3-yl)hexanamide?
The IUPAC name of N-(1-aminopentan-3-yl)hexanamide (CID 62652516) is N-(1-aminopentan-3-yl)hexanamide.
What is the SMILES notation for N-(1-aminopentan-3-yl)hexanamide?
The canonical SMILES for N-(1-aminopentan-3-yl)hexanamide is CCCCCC(=O)NC(CC)CCN.
What is the InChIKey of N-(1-aminopentan-3-yl)hexanamide?
The InChIKey is DXBJMTYSGDVOHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-3-5-6-7-11(14)13-10(4-2)8-9-12/h10H,3-9,12H2,1-2H3,(H,13,14).
What are the key properties of N-(1-aminopentan-3-yl)hexanamide?
N-(1-aminopentan-3-yl)hexanamide has a molecular weight of 200.33 g/mol, XLogP of 1.81, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminopentan-3-yl)hexanamide is sourced from PubChem (CID 62652516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).