(E)-pent-1-ene-1,2,5-triamine

C5H13N3 — CID 19787529

IUPAC(E)-pent-1-ene-1,2,5-triamine
SMILESN/C=C(/N)CCCN
InChIInChI=1S/C5H13N3/c6-3-1-2-5(8)4-7/h4H,1-3,6-8H2/b5-4+
InChIKeyLBWUPMDMOMYKTL-SNAWJCMRSA-N
MW115.18 g/mol
LogP-0.52
Rot. Bonds3

About (E)-pent-1-ene-1,2,5-triamine

(E)-pent-1-ene-1,2,5-triamine (PubChem CID 19787529) has the molecular formula C5H13N3 and a molecular weight of 115.18 g/mol. Its IUPAC name is (E)-pent-1-ene-1,2,5-triamine.

Molecular Properties

Compound Name(E)-pent-1-ene-1,2,5-triamine
PubChem CID19787529
Molecular FormulaC5H13N3
Molecular Weight115.18 g/mol
Exact Mass115.11
IUPAC Name(E)-pent-1-ene-1,2,5-triamine
SMILESN/C=C(/N)CCCN
InChIInChI=1S/C5H13N3/c6-3-1-2-5(8)4-7/h4H,1-3,6-8H2/b5-4+
InChIKeyLBWUPMDMOMYKTL-SNAWJCMRSA-N
XLogP-0.52
TPSA78.06 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 5-0.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 87760092
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CID 87989098
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CID 88846355
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CID 88866231
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CID 88957286
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CID 88966160
CID 88966160

Frequently Asked Questions

What is the IUPAC name of (E)-pent-1-ene-1,2,5-triamine?
The IUPAC name of (E)-pent-1-ene-1,2,5-triamine (CID 19787529) is (E)-pent-1-ene-1,2,5-triamine.
What is the SMILES notation for (E)-pent-1-ene-1,2,5-triamine?
The canonical SMILES for (E)-pent-1-ene-1,2,5-triamine is N/C=C(/N)CCCN.
What is the InChIKey of (E)-pent-1-ene-1,2,5-triamine?
The InChIKey is LBWUPMDMOMYKTL-SNAWJCMRSA-N. The full InChI is InChI=1S/C5H13N3/c6-3-1-2-5(8)4-7/h4H,1-3,6-8H2/b5-4+.
What are the key properties of (E)-pent-1-ene-1,2,5-triamine?
(E)-pent-1-ene-1,2,5-triamine has a molecular weight of 115.18 g/mol, XLogP of -0.52, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-pent-1-ene-1,2,5-triamine is sourced from PubChem (CID 19787529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).