N-but-1-enylpent-1-en-1-amine

C9H17N — CID 140583928

IUPACN-but-1-enylpent-1-en-1-amine
SMILESCCC=CNC=CCCC
InChIInChI=1S/C9H17N/c1-3-5-7-9-10-8-6-4-2/h6-10H,3-5H2,1-2H3
InChIKeyIXVSCFOVMUTXAT-UHFFFAOYSA-N
MW139.24 g/mol
LogP2.81
Rot. Bonds5

About N-but-1-enylpent-1-en-1-amine

N-but-1-enylpent-1-en-1-amine (PubChem CID 140583928) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is N-but-1-enylpent-1-en-1-amine.

Molecular Properties

Compound NameN-but-1-enylpent-1-en-1-amine
PubChem CID140583928
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC NameN-but-1-enylpent-1-en-1-amine
SMILESCCC=CNC=CCCC
InChIInChI=1S/C9H17N/c1-3-5-7-9-10-8-6-4-2/h6-10H,3-5H2,1-2H3
InChIKeyIXVSCFOVMUTXAT-UHFFFAOYSA-N
XLogP2.81
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-but-1-enylhex-1-en-1-amine
CID 140583923
ethene;(Z)-hept-3-ene
CID 142517945
(Z)-hex-2-ene;(E)-hex-2-ene;(E)-hex-3-ene
CID 173035981
(4Z,8E)-dodeca-4,8-diene
CID 12576906
ethane;(E)-oct-4-ene
CID 142055407
(4E,8E)-dodeca-4,8-diene
CID 12576905
octa-2,4-dien-1-amine
CID 3847298
N-but-1-enyl-N'-dec-1-enylethane-1,2-diamine
CID 88826631
(E)-1-[(Z)-but-1-enoxy]pent-1-ene
CID 173340391
pent-1-enylcarbamothioic S-acid
CID 173191733
(5E)-octa-3,5-diene
CID 173104147
N-(2-methylpropoxy)pent-1-en-1-amine
CID 57035049

Frequently Asked Questions

What is the IUPAC name of N-but-1-enylpent-1-en-1-amine?
The IUPAC name of N-but-1-enylpent-1-en-1-amine (CID 140583928) is N-but-1-enylpent-1-en-1-amine.
What is the SMILES notation for N-but-1-enylpent-1-en-1-amine?
The canonical SMILES for N-but-1-enylpent-1-en-1-amine is CCC=CNC=CCCC.
What is the InChIKey of N-but-1-enylpent-1-en-1-amine?
The InChIKey is IXVSCFOVMUTXAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N/c1-3-5-7-9-10-8-6-4-2/h6-10H,3-5H2,1-2H3.
What are the key properties of N-but-1-enylpent-1-en-1-amine?
N-but-1-enylpent-1-en-1-amine has a molecular weight of 139.24 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-but-1-enylpent-1-en-1-amine is sourced from PubChem (CID 140583928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).