(E)-pent-1-ene-1,4-diamine

C5H12N2 — CID 143973690

IUPAC(E)-pent-1-ene-1,4-diamine
SMILESCC(N)C/C=C/N
InChIInChI=1S/C5H12N2/c1-5(7)3-2-4-6/h2,4-5H,3,6-7H2,1H3/b4-2+
InChIKeyRIVJANFVPDPICH-DUXPYHPUSA-N
MW100.16 g/mol
LogP0.20
Rot. Bonds2

About (E)-pent-1-ene-1,4-diamine

(E)-pent-1-ene-1,4-diamine (PubChem CID 143973690) has the molecular formula C5H12N2 and a molecular weight of 100.16 g/mol. Its IUPAC name is (E)-pent-1-ene-1,4-diamine.

Molecular Properties

Compound Name(E)-pent-1-ene-1,4-diamine
PubChem CID143973690
Molecular FormulaC5H12N2
Molecular Weight100.16 g/mol
Exact Mass100.10
IUPAC Name(E)-pent-1-ene-1,4-diamine
SMILESCC(N)C/C=C/N
InChIInChI=1S/C5H12N2/c1-5(7)3-2-4-6/h2,4-5H,3,6-7H2,1H3/b4-2+
InChIKeyRIVJANFVPDPICH-DUXPYHPUSA-N
XLogP0.20
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.16
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(Z)-5-aminopent-4-en-2-ol
CID 130450410
(E)-hex-1-ene-1,5-diamine
CID 88688497
(4Z,6E)-7-bromohepta-4,6-dien-2-amine
CID 135199063
(E,5S)-5-aminohex-2-enoic acid
CID 55284274
(E)-dodec-4-en-2-amine
CID 55254669
(E)-5-phenylpent-4-en-2-amine
CID 55254237
5-methylhex-1-en-1-amine
CID 87108942
(2R,3S)-3-methylheptane-2,6-diamine
CID 174083116
1-N-[(E)-2-aminoethenyl]-1-N-(2-aminopropyl)propane-1,2-diamine
CID 87897317
(3R)-butane-2,3-diamine
CID 172719520
(E)-5-(4-methoxyphenyl)pent-4-en-2-amine
CID 55254782
(E)-4,6-diethylnon-1-en-1-amine
CID 163641387

Frequently Asked Questions

What is the IUPAC name of (E)-pent-1-ene-1,4-diamine?
The IUPAC name of (E)-pent-1-ene-1,4-diamine (CID 143973690) is (E)-pent-1-ene-1,4-diamine.
What is the SMILES notation for (E)-pent-1-ene-1,4-diamine?
The canonical SMILES for (E)-pent-1-ene-1,4-diamine is CC(N)C/C=C/N.
What is the InChIKey of (E)-pent-1-ene-1,4-diamine?
The InChIKey is RIVJANFVPDPICH-DUXPYHPUSA-N. The full InChI is InChI=1S/C5H12N2/c1-5(7)3-2-4-6/h2,4-5H,3,6-7H2,1H3/b4-2+.
What are the key properties of (E)-pent-1-ene-1,4-diamine?
(E)-pent-1-ene-1,4-diamine has a molecular weight of 100.16 g/mol, XLogP of 0.20, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-pent-1-ene-1,4-diamine is sourced from PubChem (CID 143973690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).