(Z)-1-N'-prop-1-en-2-ylprop-1-ene-1,1,2-triamine

C6H13N3 — CID 130436043

IUPAC(Z)-1-N'-prop-1-en-2-ylprop-1-ene-1,1,2-triamine
SMILESC=C(C)N/C(N)=C(/C)N
InChIInChI=1S/C6H13N3/c1-4(2)9-6(8)5(3)7/h9H,1,7-8H2,2-3H3/b6-5-
InChIKeyCVOOFQNPMYOORO-WAYWQWQTSA-N
MW127.19 g/mol
LogP0.22
Rot. Bonds2

About (Z)-1-N'-prop-1-en-2-ylprop-1-ene-1,1,2-triamine

(Z)-1-N'-prop-1-en-2-ylprop-1-ene-1,1,2-triamine (PubChem CID 130436043) has the molecular formula C6H13N3 and a molecular weight of 127.19 g/mol. Its IUPAC name is (Z)-1-N'-prop-1-en-2-ylprop-1-ene-1,1,2-triamine.

Molecular Properties

Compound Name(Z)-1-N'-prop-1-en-2-ylprop-1-ene-1,1,2-triamine
PubChem CID130436043
Molecular FormulaC6H13N3
Molecular Weight127.19 g/mol
Exact Mass127.11
IUPAC Name(Z)-1-N'-prop-1-en-2-ylprop-1-ene-1,1,2-triamine
SMILESC=C(C)N/C(N)=C(/C)N
InChIInChI=1S/C6H13N3/c1-4(2)9-6(8)5(3)7/h9H,1,7-8H2,2-3H3/b6-5-
InChIKeyCVOOFQNPMYOORO-WAYWQWQTSA-N
XLogP0.22
TPSA64.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 50.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-N'-prop-1-en-2-ylprop-1-ene-1,1,2-triamine?
The IUPAC name of (Z)-1-N'-prop-1-en-2-ylprop-1-ene-1,1,2-triamine (CID 130436043) is (Z)-1-N'-prop-1-en-2-ylprop-1-ene-1,1,2-triamine.
What is the SMILES notation for (Z)-1-N'-prop-1-en-2-ylprop-1-ene-1,1,2-triamine?
The canonical SMILES for (Z)-1-N'-prop-1-en-2-ylprop-1-ene-1,1,2-triamine is C=C(C)N/C(N)=C(/C)N.
What is the InChIKey of (Z)-1-N'-prop-1-en-2-ylprop-1-ene-1,1,2-triamine?
The InChIKey is CVOOFQNPMYOORO-WAYWQWQTSA-N. The full InChI is InChI=1S/C6H13N3/c1-4(2)9-6(8)5(3)7/h9H,1,7-8H2,2-3H3/b6-5-.
What are the key properties of (Z)-1-N'-prop-1-en-2-ylprop-1-ene-1,1,2-triamine?
(Z)-1-N'-prop-1-en-2-ylprop-1-ene-1,1,2-triamine has a molecular weight of 127.19 g/mol, XLogP of 0.22, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-N'-prop-1-en-2-ylprop-1-ene-1,1,2-triamine is sourced from PubChem (CID 130436043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).