(Z)-N-prop-1-en-2-ylbut-2-en-2-amine

C7H13N — CID 142199904

IUPAC(Z)-N-prop-1-en-2-ylbut-2-en-2-amine
SMILESC=C(C)N/C(C)=C\C
InChIInChI=1S/C7H13N/c1-5-7(4)8-6(2)3/h5,8H,2H2,1,3-4H3/b7-5-
InChIKeyPDVOIGRIYUGLCA-ALCCZGGFSA-N
MW111.19 g/mol
LogP2.03
Rot. Bonds2

About (Z)-N-prop-1-en-2-ylbut-2-en-2-amine

(Z)-N-prop-1-en-2-ylbut-2-en-2-amine (PubChem CID 142199904) has the molecular formula C7H13N and a molecular weight of 111.19 g/mol. Its IUPAC name is (Z)-N-prop-1-en-2-ylbut-2-en-2-amine.

Molecular Properties

Compound Name(Z)-N-prop-1-en-2-ylbut-2-en-2-amine
PubChem CID142199904
Molecular FormulaC7H13N
Molecular Weight111.19 g/mol
Exact Mass111.10
IUPAC Name(Z)-N-prop-1-en-2-ylbut-2-en-2-amine
SMILESC=C(C)N/C(C)=C\C
InChIInChI=1S/C7H13N/c1-5-7(4)8-6(2)3/h5,8H,2H2,1,3-4H3/b7-5-
InChIKeyPDVOIGRIYUGLCA-ALCCZGGFSA-N
XLogP2.03
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.19
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-prop-1-en-2-ylbut-2-en-2-amine?
The IUPAC name of (Z)-N-prop-1-en-2-ylbut-2-en-2-amine (CID 142199904) is (Z)-N-prop-1-en-2-ylbut-2-en-2-amine.
What is the SMILES notation for (Z)-N-prop-1-en-2-ylbut-2-en-2-amine?
The canonical SMILES for (Z)-N-prop-1-en-2-ylbut-2-en-2-amine is C=C(C)N/C(C)=C\C.
What is the InChIKey of (Z)-N-prop-1-en-2-ylbut-2-en-2-amine?
The InChIKey is PDVOIGRIYUGLCA-ALCCZGGFSA-N. The full InChI is InChI=1S/C7H13N/c1-5-7(4)8-6(2)3/h5,8H,2H2,1,3-4H3/b7-5-.
What are the key properties of (Z)-N-prop-1-en-2-ylbut-2-en-2-amine?
(Z)-N-prop-1-en-2-ylbut-2-en-2-amine has a molecular weight of 111.19 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-prop-1-en-2-ylbut-2-en-2-amine is sourced from PubChem (CID 142199904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).