6-amino-N-cyclopropyl-N-(3-methylbutyl)hexanamide

C14H28N2O — CID 54870672

IUPAC6-amino-N-cyclopropyl-N-(3-methylbutyl)hexanamide
SMILESCC(C)CCN(C(=O)CCCCCN)C1CC1
InChIInChI=1S/C14H28N2O/c1-12(2)9-11-16(13-7-8-13)14(17)6-4-3-5-10-15/h12-13H,3-11,15H2,1-2H3
InChIKeyLDNZLSMVIXFPGW-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.54
Rot. Bonds9

About 6-amino-N-cyclopropyl-N-(3-methylbutyl)hexanamide

6-amino-N-cyclopropyl-N-(3-methylbutyl)hexanamide (PubChem CID 54870672) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 6-amino-N-cyclopropyl-N-(3-methylbutyl)hexanamide.

Molecular Properties

Compound Name6-amino-N-cyclopropyl-N-(3-methylbutyl)hexanamide
PubChem CID54870672
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name6-amino-N-cyclopropyl-N-(3-methylbutyl)hexanamide
SMILESCC(C)CCN(C(=O)CCCCCN)C1CC1
InChIInChI=1S/C14H28N2O/c1-12(2)9-11-16(13-7-8-13)14(17)6-4-3-5-10-15/h12-13H,3-11,15H2,1-2H3
InChIKeyLDNZLSMVIXFPGW-UHFFFAOYSA-N
XLogP2.54
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-amino-N-cyclopropyl-N-(3-methylbutyl)butanamide;hydrochloride
CID 119292359
N-(3-aminopropyl)-N-cyclopropyloctanamide
CID 43136708
N-(3-aminopropyl)-N-cycloheptyl-4-methylpentanamide
CID 43319420
7-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]heptanamide
CID 60954276
2-bromo-N-cyclopropyl-N-(3-methylbutyl)acetamide
CID 63679316
5-amino-N-cyclobutyl-N-(3-hydroxypropyl)pentanamide
CID 102861717
N-(3-aminopropyl)-N-cyclobutylhexanamide
CID 102873870
N-(2-aminoethyl)-N-cyclobutylheptanamide
CID 102874052
N-(3-aminopropyl)-N-cycloheptylheptanamide
CID 114751887
5-amino-N-cyclopentyl-2-methyl-N-(3-methylbutyl)pentanamide
CID 104685340
7-amino-N-cyclopropyl-N-(3-methylpentan-2-yl)heptanamide
CID 119776954
7-amino-N-methyl-N-(2-methylpropyl)heptanamide
CID 43272143

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-cyclopropyl-N-(3-methylbutyl)hexanamide?
The IUPAC name of 6-amino-N-cyclopropyl-N-(3-methylbutyl)hexanamide (CID 54870672) is 6-amino-N-cyclopropyl-N-(3-methylbutyl)hexanamide.
What is the SMILES notation for 6-amino-N-cyclopropyl-N-(3-methylbutyl)hexanamide?
The canonical SMILES for 6-amino-N-cyclopropyl-N-(3-methylbutyl)hexanamide is CC(C)CCN(C(=O)CCCCCN)C1CC1.
What is the InChIKey of 6-amino-N-cyclopropyl-N-(3-methylbutyl)hexanamide?
The InChIKey is LDNZLSMVIXFPGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-12(2)9-11-16(13-7-8-13)14(17)6-4-3-5-10-15/h12-13H,3-11,15H2,1-2H3.
What are the key properties of 6-amino-N-cyclopropyl-N-(3-methylbutyl)hexanamide?
6-amino-N-cyclopropyl-N-(3-methylbutyl)hexanamide has a molecular weight of 240.39 g/mol, XLogP of 2.54, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-cyclopropyl-N-(3-methylbutyl)hexanamide is sourced from PubChem (CID 54870672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).