N-butyl-N-[5-(butylamino)pentyl]propanamide

C16H34N2O — CID 142121020

IUPACN-butyl-N-[5-(butylamino)pentyl]propanamide
SMILESCCCCNCCCCCN(CCCC)C(=O)CC
InChIInChI=1S/C16H34N2O/c1-4-7-12-17-13-10-9-11-15-18(14-8-5-2)16(19)6-3/h17H,4-15H2,1-3H3
InChIKeyDIOKSVIBULLLPY-UHFFFAOYSA-N
MW270.46 g/mol
LogP3.59
Rot. Bonds13

About N-butyl-N-[5-(butylamino)pentyl]propanamide

N-butyl-N-[5-(butylamino)pentyl]propanamide (PubChem CID 142121020) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is N-butyl-N-[5-(butylamino)pentyl]propanamide.

Molecular Properties

Compound NameN-butyl-N-[5-(butylamino)pentyl]propanamide
PubChem CID142121020
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC NameN-butyl-N-[5-(butylamino)pentyl]propanamide
SMILESCCCCNCCCCCN(CCCC)C(=O)CC
InChIInChI=1S/C16H34N2O/c1-4-7-12-17-13-10-9-11-15-18(14-8-5-2)16(19)6-3/h17H,4-15H2,1-3H3
InChIKeyDIOKSVIBULLLPY-UHFFFAOYSA-N
XLogP3.59
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-butyl-N-[5-(butylamino)pentyl]propanamide 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-butyl-N-[5-(butylamino)pentyl]-3,3-dimethylbutanamide
CID 58848837
N,N-didecyl-8-(octylamino)octanamide
CID 172581253
4-[[4-(dioctylamino)-4-oxobutyl]amino]-N,N-dioctylbutanamide
CID 164875605
dihexylcarbamic acid;N-hexylhexan-1-amine
CID 174945078
N-[3-(dibutylamino)propyl]-N-octadecylpropanamide
CID 146463655
N-(2-acetamidoethyl)-N-butylpropanamide
CID 170264353
3-[6-[2-carboxyethyl(tridecanoyl)amino]hexylamino]propanoic acid
CID 21328693
N-butyl-N-(2-chloroethyl)propanamide
CID 63390792
N-(3-aminopropyl)-N-butylpropanamide;ethane
CID 142121594
2-chloro-N,N-di(nonyl)acetamide
CID 533173
N-butyl-N-octyldecanamide
CID 18913402
N-butyl-N-(5-piperidin-1-ylpentyl)propanamide
CID 142122170

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-[5-(butylamino)pentyl]propanamide?
The IUPAC name of N-butyl-N-[5-(butylamino)pentyl]propanamide (CID 142121020) is N-butyl-N-[5-(butylamino)pentyl]propanamide.
What is the SMILES notation for N-butyl-N-[5-(butylamino)pentyl]propanamide?
The canonical SMILES for N-butyl-N-[5-(butylamino)pentyl]propanamide is CCCCNCCCCCN(CCCC)C(=O)CC.
What is the InChIKey of N-butyl-N-[5-(butylamino)pentyl]propanamide?
The InChIKey is DIOKSVIBULLLPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-4-7-12-17-13-10-9-11-15-18(14-8-5-2)16(19)6-3/h17H,4-15H2,1-3H3.
What are the key properties of N-butyl-N-[5-(butylamino)pentyl]propanamide?
N-butyl-N-[5-(butylamino)pentyl]propanamide has a molecular weight of 270.46 g/mol, XLogP of 3.59, 13 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-[5-(butylamino)pentyl]propanamide is sourced from PubChem (CID 142121020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).