(Z)-2-[[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]amino]-3,3-dimethylbut-1-en-1-amine

C14H20N2 — CID 129143105

IUPAC(Z)-2-[[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]amino]-3,3-dimethylbut-1-en-1-amine
SMILESC/C=C1/C=CC=C/C1=N\C(=C/N)C(C)(C)C
InChIInChI=1S/C14H20N2/c1-5-11-8-6-7-9-12(11)16-13(10-15)14(2,3)4/h5-10H,15H2,1-4H3/b11-5-,13-10-,16-12+
InChIKeyDGYCGWOGBMMXGO-LPQWYYMHSA-N
MW216.33 g/mol
LogP3.35
Rot. Bonds1

About (Z)-2-[[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]amino]-3,3-dimethylbut-1-en-1-amine

(Z)-2-[[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]amino]-3,3-dimethylbut-1-en-1-amine (PubChem CID 129143105) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is (Z)-2-[[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]amino]-3,3-dimethylbut-1-en-1-amine.

Molecular Properties

Compound Name(Z)-2-[[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]amino]-3,3-dimethylbut-1-en-1-amine
PubChem CID129143105
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name(Z)-2-[[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]amino]-3,3-dimethylbut-1-en-1-amine
SMILESC/C=C1/C=CC=C/C1=N\C(=C/N)C(C)(C)C
InChIInChI=1S/C14H20N2/c1-5-11-8-6-7-9-12(11)16-13(10-15)14(2,3)4/h5-10H,15H2,1-4H3/b11-5-,13-10-,16-12+
InChIKeyDGYCGWOGBMMXGO-LPQWYYMHSA-N
XLogP3.35
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 53.35
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)-2-[[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]amino]-3,3-dimethylbut-1-en-1-amine?
The IUPAC name of (Z)-2-[[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]amino]-3,3-dimethylbut-1-en-1-amine (CID 129143105) is (Z)-2-[[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]amino]-3,3-dimethylbut-1-en-1-amine.
What is the SMILES notation for (Z)-2-[[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]amino]-3,3-dimethylbut-1-en-1-amine?
The canonical SMILES for (Z)-2-[[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]amino]-3,3-dimethylbut-1-en-1-amine is C/C=C1/C=CC=C/C1=N\C(=C/N)C(C)(C)C.
What is the InChIKey of (Z)-2-[[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]amino]-3,3-dimethylbut-1-en-1-amine?
The InChIKey is DGYCGWOGBMMXGO-LPQWYYMHSA-N. The full InChI is InChI=1S/C14H20N2/c1-5-11-8-6-7-9-12(11)16-13(10-15)14(2,3)4/h5-10H,15H2,1-4H3/b11-5-,13-10-,16-12+.
What are the key properties of (Z)-2-[[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]amino]-3,3-dimethylbut-1-en-1-amine?
(Z)-2-[[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]amino]-3,3-dimethylbut-1-en-1-amine has a molecular weight of 216.33 g/mol, XLogP of 3.35, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-[[(6Z)-6-ethylidenecyclohexa-2,4-dien-1-ylidene]amino]-3,3-dimethylbut-1-en-1-amine is sourced from PubChem (CID 129143105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).