(Z)-2-methyl-4-N-prop-1-en-2-ylpent-1-ene-1,4-diamine

C9H18N2 — CID 166966748

IUPAC(Z)-2-methyl-4-N-prop-1-en-2-ylpent-1-ene-1,4-diamine
SMILESC=C(C)NC(C)C/C(C)=C\N
InChIInChI=1S/C9H18N2/c1-7(2)11-9(4)5-8(3)6-10/h6,9,11H,1,5,10H2,2-4H3/b8-6-
InChIKeyYBPYJYFACWPMHZ-VURMDHGXSA-N
MW154.26 g/mol
LogP1.75
Rot. Bonds4

About (Z)-2-methyl-4-N-prop-1-en-2-ylpent-1-ene-1,4-diamine

(Z)-2-methyl-4-N-prop-1-en-2-ylpent-1-ene-1,4-diamine (PubChem CID 166966748) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is (Z)-2-methyl-4-N-prop-1-en-2-ylpent-1-ene-1,4-diamine.

Molecular Properties

Compound Name(Z)-2-methyl-4-N-prop-1-en-2-ylpent-1-ene-1,4-diamine
PubChem CID166966748
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name(Z)-2-methyl-4-N-prop-1-en-2-ylpent-1-ene-1,4-diamine
SMILESC=C(C)NC(C)C/C(C)=C\N
InChIInChI=1S/C9H18N2/c1-7(2)11-9(4)5-8(3)6-10/h6,9,11H,1,5,10H2,2-4H3/b8-6-
InChIKeyYBPYJYFACWPMHZ-VURMDHGXSA-N
XLogP1.75
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-methyl-4-N-prop-1-en-2-ylpent-1-ene-1,4-diamine?
The IUPAC name of (Z)-2-methyl-4-N-prop-1-en-2-ylpent-1-ene-1,4-diamine (CID 166966748) is (Z)-2-methyl-4-N-prop-1-en-2-ylpent-1-ene-1,4-diamine.
What is the SMILES notation for (Z)-2-methyl-4-N-prop-1-en-2-ylpent-1-ene-1,4-diamine?
The canonical SMILES for (Z)-2-methyl-4-N-prop-1-en-2-ylpent-1-ene-1,4-diamine is C=C(C)NC(C)C/C(C)=C\N.
What is the InChIKey of (Z)-2-methyl-4-N-prop-1-en-2-ylpent-1-ene-1,4-diamine?
The InChIKey is YBPYJYFACWPMHZ-VURMDHGXSA-N. The full InChI is InChI=1S/C9H18N2/c1-7(2)11-9(4)5-8(3)6-10/h6,9,11H,1,5,10H2,2-4H3/b8-6-.
What are the key properties of (Z)-2-methyl-4-N-prop-1-en-2-ylpent-1-ene-1,4-diamine?
(Z)-2-methyl-4-N-prop-1-en-2-ylpent-1-ene-1,4-diamine has a molecular weight of 154.26 g/mol, XLogP of 1.75, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-methyl-4-N-prop-1-en-2-ylpent-1-ene-1,4-diamine is sourced from PubChem (CID 166966748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).