(Z)-N,3-dimethyl-4-(methylideneamino)pent-3-en-1-amine

C8H16N2 — CID 155070930

IUPAC(Z)-N,3-dimethyl-4-(methylideneamino)pent-3-en-1-amine
SMILESC=N/C(C)=C(/C)CCNC
InChIInChI=1S/C8H16N2/c1-7(5-6-9-3)8(2)10-4/h9H,4-6H2,1-3H3/b8-7-
InChIKeyBVOZZOJEYWAUSP-FPLPWBNLSA-N
MW140.23 g/mol
LogP1.59
Rot. Bonds4

About (Z)-N,3-dimethyl-4-(methylideneamino)pent-3-en-1-amine

(Z)-N,3-dimethyl-4-(methylideneamino)pent-3-en-1-amine (PubChem CID 155070930) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is (Z)-N,3-dimethyl-4-(methylideneamino)pent-3-en-1-amine.

Molecular Properties

Compound Name(Z)-N,3-dimethyl-4-(methylideneamino)pent-3-en-1-amine
PubChem CID155070930
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name(Z)-N,3-dimethyl-4-(methylideneamino)pent-3-en-1-amine
SMILESC=N/C(C)=C(/C)CCNC
InChIInChI=1S/C8H16N2/c1-7(5-6-9-3)8(2)10-4/h9H,4-6H2,1-3H3/b8-7-
InChIKeyBVOZZOJEYWAUSP-FPLPWBNLSA-N
XLogP1.59
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-N,3-dimethyl-4-(methylideneamino)pent-3-en-1-amine?
The IUPAC name of (Z)-N,3-dimethyl-4-(methylideneamino)pent-3-en-1-amine (CID 155070930) is (Z)-N,3-dimethyl-4-(methylideneamino)pent-3-en-1-amine.
What is the SMILES notation for (Z)-N,3-dimethyl-4-(methylideneamino)pent-3-en-1-amine?
The canonical SMILES for (Z)-N,3-dimethyl-4-(methylideneamino)pent-3-en-1-amine is C=N/C(C)=C(/C)CCNC.
What is the InChIKey of (Z)-N,3-dimethyl-4-(methylideneamino)pent-3-en-1-amine?
The InChIKey is BVOZZOJEYWAUSP-FPLPWBNLSA-N. The full InChI is InChI=1S/C8H16N2/c1-7(5-6-9-3)8(2)10-4/h9H,4-6H2,1-3H3/b8-7-.
What are the key properties of (Z)-N,3-dimethyl-4-(methylideneamino)pent-3-en-1-amine?
(Z)-N,3-dimethyl-4-(methylideneamino)pent-3-en-1-amine has a molecular weight of 140.23 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,3-dimethyl-4-(methylideneamino)pent-3-en-1-amine is sourced from PubChem (CID 155070930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).