(Z)-N-butylpent-3-en-1-amine

C9H19N — CID 15570250

IUPAC(Z)-N-butylpent-3-en-1-amine
SMILESC/C=C\CCNCCCC
InChIInChI=1S/C9H19N/c1-3-5-7-9-10-8-6-4-2/h3,5,10H,4,6-9H2,1-2H3/b5-3-
InChIKeyBYSVVXBUSHBTPZ-HYXAFXHYSA-N
MW141.26 g/mol
LogP2.34
Rot. Bonds6

About (Z)-N-butylpent-3-en-1-amine

(Z)-N-butylpent-3-en-1-amine (PubChem CID 15570250) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is (Z)-N-butylpent-3-en-1-amine.

Molecular Properties

Compound Name(Z)-N-butylpent-3-en-1-amine
PubChem CID15570250
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC Name(Z)-N-butylpent-3-en-1-amine
SMILESC/C=C\CCNCCCC
InChIInChI=1S/C9H19N/c1-3-5-7-9-10-8-6-4-2/h3,5,10H,4,6-9H2,1-2H3/b5-3-
InChIKeyBYSVVXBUSHBTPZ-HYXAFXHYSA-N
XLogP2.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-butylpent-3-en-1-amine?
The IUPAC name of (Z)-N-butylpent-3-en-1-amine (CID 15570250) is (Z)-N-butylpent-3-en-1-amine.
What is the SMILES notation for (Z)-N-butylpent-3-en-1-amine?
The canonical SMILES for (Z)-N-butylpent-3-en-1-amine is C/C=C\CCNCCCC.
What is the InChIKey of (Z)-N-butylpent-3-en-1-amine?
The InChIKey is BYSVVXBUSHBTPZ-HYXAFXHYSA-N. The full InChI is InChI=1S/C9H19N/c1-3-5-7-9-10-8-6-4-2/h3,5,10H,4,6-9H2,1-2H3/b5-3-.
What are the key properties of (Z)-N-butylpent-3-en-1-amine?
(Z)-N-butylpent-3-en-1-amine has a molecular weight of 141.26 g/mol, XLogP of 2.34, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-butylpent-3-en-1-amine is sourced from PubChem (CID 15570250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).