N-(cyclopentylidenemethyl)butan-1-amine

C10H19N — CID 167152600

IUPACN-(cyclopentylidenemethyl)butan-1-amine
SMILESCCCCNC=C1CCCC1
InChIInChI=1S/C10H19N/c1-2-3-8-11-9-10-6-4-5-7-10/h9,11H,2-8H2,1H3
InChIKeyMSVHRXJMMOIYSA-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.83
Rot. Bonds4

About N-(cyclopentylidenemethyl)butan-1-amine

N-(cyclopentylidenemethyl)butan-1-amine (PubChem CID 167152600) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is N-(cyclopentylidenemethyl)butan-1-amine.

Molecular Properties

Compound NameN-(cyclopentylidenemethyl)butan-1-amine
PubChem CID167152600
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC NameN-(cyclopentylidenemethyl)butan-1-amine
SMILESCCCCNC=C1CCCC1
InChIInChI=1S/C10H19N/c1-2-3-8-11-9-10-6-4-5-7-10/h9,11H,2-8H2,1H3
InChIKeyMSVHRXJMMOIYSA-UHFFFAOYSA-N
XLogP2.83
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylidenemethyl)butan-1-amine?
The IUPAC name of N-(cyclopentylidenemethyl)butan-1-amine (CID 167152600) is N-(cyclopentylidenemethyl)butan-1-amine.
What is the SMILES notation for N-(cyclopentylidenemethyl)butan-1-amine?
The canonical SMILES for N-(cyclopentylidenemethyl)butan-1-amine is CCCCNC=C1CCCC1.
What is the InChIKey of N-(cyclopentylidenemethyl)butan-1-amine?
The InChIKey is MSVHRXJMMOIYSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-2-3-8-11-9-10-6-4-5-7-10/h9,11H,2-8H2,1H3.
What are the key properties of N-(cyclopentylidenemethyl)butan-1-amine?
N-(cyclopentylidenemethyl)butan-1-amine has a molecular weight of 153.27 g/mol, XLogP of 2.83, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylidenemethyl)butan-1-amine is sourced from PubChem (CID 167152600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).