N-(2-aminoethyl)-N-cyclobutylheptanamide

C13H26N2O — CID 102874052

IUPACN-(2-aminoethyl)-N-cyclobutylheptanamide
SMILESCCCCCCC(=O)N(CCN)C1CCC1
InChIInChI=1S/C13H26N2O/c1-2-3-4-5-9-13(16)15(11-10-14)12-7-6-8-12/h12H,2-11,14H2,1H3
InChIKeyUAFUCROQHXFJLP-UHFFFAOYSA-N
MW226.36 g/mol
LogP2.30
Rot. Bonds8

About N-(2-aminoethyl)-N-cyclobutylheptanamide

N-(2-aminoethyl)-N-cyclobutylheptanamide (PubChem CID 102874052) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-(2-aminoethyl)-N-cyclobutylheptanamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N-cyclobutylheptanamide
PubChem CID102874052
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-(2-aminoethyl)-N-cyclobutylheptanamide
SMILESCCCCCCC(=O)N(CCN)C1CCC1
InChIInChI=1S/C13H26N2O/c1-2-3-4-5-9-13(16)15(11-10-14)12-7-6-8-12/h12H,2-11,14H2,1H3
InChIKeyUAFUCROQHXFJLP-UHFFFAOYSA-N
XLogP2.30
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.30
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

N-(3-aminopropyl)-N-cyclobutylhexanamide
CID 102873870
N-(3-aminopropyl)-N-cycloheptylheptanamide
CID 114751887
N-(3-aminopropyl)-N-cyclopropyloctanamide
CID 43136708
N-(2-bromoethyl)-N-cyclobutyloctanamide
CID 102873095
N-cyclobutyl-N-(3-hydroxypropyl)decanamide
CID 102866665
N-(2-chloroethyl)-N-cyclohexyloctanamide
CID 63391554
N-(2-chloroethyl)-N-cyclopropylnonanamide
CID 65426813
N-(2-bromoethyl)-N-cyclohexyloctanamide
CID 80658420
N-(3-amino-3-sulfanylidenepropyl)-N-cyclopropylnonanamide
CID 65447660
N-(3-amino-3-sulfanylidenepropyl)-N-cyclopropyloctanamide
CID 54996806
N-(3-amino-3-sulfanylidenepropyl)-N-cyclopropyldecanamide
CID 65447661
7-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]heptanamide
CID 60954276

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N-cyclobutylheptanamide?
The IUPAC name of N-(2-aminoethyl)-N-cyclobutylheptanamide (CID 102874052) is N-(2-aminoethyl)-N-cyclobutylheptanamide.
What is the SMILES notation for N-(2-aminoethyl)-N-cyclobutylheptanamide?
The canonical SMILES for N-(2-aminoethyl)-N-cyclobutylheptanamide is CCCCCCC(=O)N(CCN)C1CCC1.
What is the InChIKey of N-(2-aminoethyl)-N-cyclobutylheptanamide?
The InChIKey is UAFUCROQHXFJLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-2-3-4-5-9-13(16)15(11-10-14)12-7-6-8-12/h12H,2-11,14H2,1H3.
What are the key properties of N-(2-aminoethyl)-N-cyclobutylheptanamide?
N-(2-aminoethyl)-N-cyclobutylheptanamide has a molecular weight of 226.36 g/mol, XLogP of 2.30, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N-cyclobutylheptanamide is sourced from PubChem (CID 102874052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).