1-pent-2-en-3-ylazetidin-3-amine

C8H16N2 — CID 123700595

IUPAC1-pent-2-en-3-ylazetidin-3-amine
SMILESCC=C(CC)N1CC(N)C1
InChIInChI=1S/C8H16N2/c1-3-8(4-2)10-5-7(9)6-10/h3,7H,4-6,9H2,1-2H3
InChIKeyKOXFQRSGZWGBSN-UHFFFAOYSA-N
MW140.23 g/mol
LogP0.94
Rot. Bonds2

About 1-pent-2-en-3-ylazetidin-3-amine

1-pent-2-en-3-ylazetidin-3-amine (PubChem CID 123700595) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 1-pent-2-en-3-ylazetidin-3-amine.

Molecular Properties

Compound Name1-pent-2-en-3-ylazetidin-3-amine
PubChem CID123700595
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name1-pent-2-en-3-ylazetidin-3-amine
SMILESCC=C(CC)N1CC(N)C1
InChIInChI=1S/C8H16N2/c1-3-8(4-2)10-5-7(9)6-10/h3,7H,4-6,9H2,1-2H3
InChIKeyKOXFQRSGZWGBSN-UHFFFAOYSA-N
XLogP0.94
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-pent-2-en-3-ylazetidin-3-amine?
The IUPAC name of 1-pent-2-en-3-ylazetidin-3-amine (CID 123700595) is 1-pent-2-en-3-ylazetidin-3-amine.
What is the SMILES notation for 1-pent-2-en-3-ylazetidin-3-amine?
The canonical SMILES for 1-pent-2-en-3-ylazetidin-3-amine is CC=C(CC)N1CC(N)C1.
What is the InChIKey of 1-pent-2-en-3-ylazetidin-3-amine?
The InChIKey is KOXFQRSGZWGBSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-3-8(4-2)10-5-7(9)6-10/h3,7H,4-6,9H2,1-2H3.
What are the key properties of 1-pent-2-en-3-ylazetidin-3-amine?
1-pent-2-en-3-ylazetidin-3-amine has a molecular weight of 140.23 g/mol, XLogP of 0.94, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pent-2-en-3-ylazetidin-3-amine is sourced from PubChem (CID 123700595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).