N-ethenylpentan-1-amine

C7H15N — CID 87131661

IUPACN-ethenylpentan-1-amine
SMILESC=CNCCCCC
InChIInChI=1S/C7H15N/c1-3-5-6-7-8-4-2/h4,8H,2-3,5-7H2,1H3
InChIKeyDVSVWABUGHVOLR-UHFFFAOYSA-N
MW113.20 g/mol
LogP1.91
Rot. Bonds5

About N-ethenylpentan-1-amine

N-ethenylpentan-1-amine (PubChem CID 87131661) has the molecular formula C7H15N and a molecular weight of 113.20 g/mol. Its IUPAC name is N-ethenylpentan-1-amine.

Molecular Properties

Compound NameN-ethenylpentan-1-amine
PubChem CID87131661
Molecular FormulaC7H15N
Molecular Weight113.20 g/mol
Exact Mass113.12
IUPAC NameN-ethenylpentan-1-amine
SMILESC=CNCCCCC
InChIInChI=1S/C7H15N/c1-3-5-6-7-8-4-2/h4,8H,2-3,5-7H2,1H3
InChIKeyDVSVWABUGHVOLR-UHFFFAOYSA-N
XLogP1.91
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.20
LogP ≤ 51.91
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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Related Compounds

N-ethenyltetradecan-1-amine
CID 175788828
N-ethenylpropan-1-amine;methane
CID 158278470
ethane;N-pentylformamide
CID 145350301
N-tetracosylformamide
CID 54077607
N-pentacosylformamide
CID 88723962
1-ethenyl-2-hexylhydrazine
CID 166144397
4-dimethylsilyl-N-ethenylbutan-1-amine
CID 154083369
N-ethenylpent-4-en-1-amine
CID 142515999
N-pent-4-enyloctan-1-amine
CID 79006791
N-ethenylhept-6-en-1-amine
CID 145124117
N-[(E)-prop-1-enyl]dodecan-1-amine
CID 88674859
N-prop-2-enyltridecan-1-amine
CID 22467882

Frequently Asked Questions

What is the IUPAC name of N-ethenylpentan-1-amine?
The IUPAC name of N-ethenylpentan-1-amine (CID 87131661) is N-ethenylpentan-1-amine.
What is the SMILES notation for N-ethenylpentan-1-amine?
The canonical SMILES for N-ethenylpentan-1-amine is C=CNCCCCC.
What is the InChIKey of N-ethenylpentan-1-amine?
The InChIKey is DVSVWABUGHVOLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N/c1-3-5-6-7-8-4-2/h4,8H,2-3,5-7H2,1H3.
What are the key properties of N-ethenylpentan-1-amine?
N-ethenylpentan-1-amine has a molecular weight of 113.20 g/mol, XLogP of 1.91, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenylpentan-1-amine is sourced from PubChem (CID 87131661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).