N-(3-bromopropyl)-N-cyclobutyl-3-cyclopentylpropanamide

C15H26BrNO — CID 102872516

IUPACN-(3-bromopropyl)-N-cyclobutyl-3-cyclopentylpropanamide
SMILESO=C(CCC1CCCC1)N(CCCBr)C1CCC1
InChIInChI=1S/C15H26BrNO/c16-11-4-12-17(14-7-3-8-14)15(18)10-9-13-5-1-2-6-13/h13-14H,1-12H2
InChIKeyWZUYOJSXPXBPPX-UHFFFAOYSA-N
MW316.28 g/mol
LogP4.12
Rot. Bonds7

About N-(3-bromopropyl)-N-cyclobutyl-3-cyclopentylpropanamide

N-(3-bromopropyl)-N-cyclobutyl-3-cyclopentylpropanamide (PubChem CID 102872516) has the molecular formula C15H26BrNO and a molecular weight of 316.28 g/mol. Its IUPAC name is N-(3-bromopropyl)-N-cyclobutyl-3-cyclopentylpropanamide.

Molecular Properties

Compound NameN-(3-bromopropyl)-N-cyclobutyl-3-cyclopentylpropanamide
PubChem CID102872516
Molecular FormulaC15H26BrNO
Molecular Weight316.28 g/mol
Exact Mass315.12
IUPAC NameN-(3-bromopropyl)-N-cyclobutyl-3-cyclopentylpropanamide
SMILESO=C(CCC1CCCC1)N(CCCBr)C1CCC1
InChIInChI=1S/C15H26BrNO/c16-11-4-12-17(14-7-3-8-14)15(18)10-9-13-5-1-2-6-13/h13-14H,1-12H2
InChIKeyWZUYOJSXPXBPPX-UHFFFAOYSA-N
XLogP4.12
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.28
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-(3-bromopropyl)-N-cyclobutyl-3-cyclopentylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-bromoethyl)-N-cyclobutyl-3-cyclopentylpropanamide
CID 102873270
N-(2-chloroethyl)-N,3-dicyclohexylpropanamide
CID 63391329
N-(2-chloroethyl)-3-cyclopentyl-N-cyclopropylpropanamide
CID 63394667
N-(2-chloroethyl)-3-cyclohexyl-N-cyclopropylpropanamide
CID 55186483
N-(3-bromopropyl)-N-cyclobutylpropanamide
CID 102872394
N-(2-bromoethyl)-N-cyclobutyl-2-cycloheptylacetamide
CID 102873056
3-(4-aminocyclohexyl)-N-cyclobutyl-N-(2-hydroxyethyl)propanamide
CID 102871199
3-bromo-N-cyclobutyl-N-(2-hydroxyethyl)propanamide
CID 102861214
2-[3-cyclohexylpropanoyl(cyclopropyl)amino]acetic acid
CID 54946141
N-(2-bromoethyl)-N-cyclohexyl-4,4,4-trifluorobutanamide
CID 80659519
N-cyclohexyl-3-cyclopentyl-N-methylpropanamide
CID 86976959
N-(2-bromoethyl)-N-cyclohexyloctanamide
CID 80658420

Frequently Asked Questions

What is the IUPAC name of N-(3-bromopropyl)-N-cyclobutyl-3-cyclopentylpropanamide?
The IUPAC name of N-(3-bromopropyl)-N-cyclobutyl-3-cyclopentylpropanamide (CID 102872516) is N-(3-bromopropyl)-N-cyclobutyl-3-cyclopentylpropanamide.
What is the SMILES notation for N-(3-bromopropyl)-N-cyclobutyl-3-cyclopentylpropanamide?
The canonical SMILES for N-(3-bromopropyl)-N-cyclobutyl-3-cyclopentylpropanamide is O=C(CCC1CCCC1)N(CCCBr)C1CCC1.
What is the InChIKey of N-(3-bromopropyl)-N-cyclobutyl-3-cyclopentylpropanamide?
The InChIKey is WZUYOJSXPXBPPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26BrNO/c16-11-4-12-17(14-7-3-8-14)15(18)10-9-13-5-1-2-6-13/h13-14H,1-12H2.
What are the key properties of N-(3-bromopropyl)-N-cyclobutyl-3-cyclopentylpropanamide?
N-(3-bromopropyl)-N-cyclobutyl-3-cyclopentylpropanamide has a molecular weight of 316.28 g/mol, XLogP of 4.12, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromopropyl)-N-cyclobutyl-3-cyclopentylpropanamide is sourced from PubChem (CID 102872516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).