N-(3-aminopropyl)-4-cyclopentylbutanamide

C12H24N2O — CID 119409090

IUPACN-(3-aminopropyl)-4-cyclopentylbutanamide
SMILESNCCCNC(=O)CCCC1CCCC1
InChIInChI=1S/C12H24N2O/c13-9-4-10-14-12(15)8-3-7-11-5-1-2-6-11/h11H,1-10,13H2,(H,14,15)
InChIKeyYMRLNHBLFSYYHH-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.81
Rot. Bonds7

About N-(3-aminopropyl)-4-cyclopentylbutanamide

N-(3-aminopropyl)-4-cyclopentylbutanamide (PubChem CID 119409090) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is N-(3-aminopropyl)-4-cyclopentylbutanamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-4-cyclopentylbutanamide
PubChem CID119409090
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC NameN-(3-aminopropyl)-4-cyclopentylbutanamide
SMILESNCCCNC(=O)CCCC1CCCC1
InChIInChI=1S/C12H24N2O/c13-9-4-10-14-12(15)8-3-7-11-5-1-2-6-11/h11H,1-10,13H2,(H,14,15)
InChIKeyYMRLNHBLFSYYHH-UHFFFAOYSA-N
XLogP1.81
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
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-(3-aminopropyl)-2-cyclopentylacetamide
CID 24706958
6-(4-cyclopentylbutanoylamino)hexanoic acid
CID 119220158
4-chloro-N-(3-cyclopentylpropyl)butanamide
CID 106009634
3-(4-cyclohexylbutanoylamino)propanoic acid
CID 43241269
3-cyclopentyl-N-[7-(3-cyclopentylpropanoylamino)heptyl]propanamide
CID 5183874
4-cyclohexyl-N-[3-[4-[3-(4-cyclohexylbutanoylamino)propyl]piperazin-1-yl]propyl]butanamide
CID 70429171
N-(3-aminopropyl)-3-piperidin-4-ylpropanamide
CID 62211796
4-amino-N-(cyclopentylmethyl)butanamide
CID 43371168
4-(2-aminoethyl)-N-(3-cyclopentylpropyl)-5-methylhexanamide
CID 106011723
4-(3-cyclodecylpropylamino)-4-oxobutanoic acid
CID 146506489
4-cyclopentyl-N-[2-(ethylamino)ethyl]butanamide;hydrochloride
CID 119509622
4-chloro-N-(2-cyclopentylethyl)butanamide
CID 63307990

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-4-cyclopentylbutanamide?
The IUPAC name of N-(3-aminopropyl)-4-cyclopentylbutanamide (CID 119409090) is N-(3-aminopropyl)-4-cyclopentylbutanamide.
What is the SMILES notation for N-(3-aminopropyl)-4-cyclopentylbutanamide?
The canonical SMILES for N-(3-aminopropyl)-4-cyclopentylbutanamide is NCCCNC(=O)CCCC1CCCC1.
What is the InChIKey of N-(3-aminopropyl)-4-cyclopentylbutanamide?
The InChIKey is YMRLNHBLFSYYHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c13-9-4-10-14-12(15)8-3-7-11-5-1-2-6-11/h11H,1-10,13H2,(H,14,15).
What are the key properties of N-(3-aminopropyl)-4-cyclopentylbutanamide?
N-(3-aminopropyl)-4-cyclopentylbutanamide has a molecular weight of 212.34 g/mol, XLogP of 1.81, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-4-cyclopentylbutanamide is sourced from PubChem (CID 119409090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).