(1Z,5Z)-3-N,4-N-dimethyl-1,6-bis(methylideneamino)hexa-1,5-diene-3,4-diamine

C10H18N4 — CID 138527605

IUPAC(1Z,5Z)-3-N,4-N-dimethyl-1,6-bis(methylideneamino)hexa-1,5-diene-3,4-diamine
SMILESC=N/C=C\C(NC)C(/C=C\N=C)NC
InChIInChI=1S/C10H18N4/c1-11-7-5-9(13-3)10(14-4)6-8-12-2/h5-10,13-14H,1-2H2,3-4H3/b7-5-,8-6-
InChIKeyYKVHZSQFVAHSHR-SFECMWDFSA-N
MW194.28 g/mol
LogP0.59
Rot. Bonds7

About (1Z,5Z)-3-N,4-N-dimethyl-1,6-bis(methylideneamino)hexa-1,5-diene-3,4-diamine

(1Z,5Z)-3-N,4-N-dimethyl-1,6-bis(methylideneamino)hexa-1,5-diene-3,4-diamine (PubChem CID 138527605) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is (1Z,5Z)-3-N,4-N-dimethyl-1,6-bis(methylideneamino)hexa-1,5-diene-3,4-diamine.

Molecular Properties

Compound Name(1Z,5Z)-3-N,4-N-dimethyl-1,6-bis(methylideneamino)hexa-1,5-diene-3,4-diamine
PubChem CID138527605
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name(1Z,5Z)-3-N,4-N-dimethyl-1,6-bis(methylideneamino)hexa-1,5-diene-3,4-diamine
SMILESC=N/C=C\C(NC)C(/C=C\N=C)NC
InChIInChI=1S/C10H18N4/c1-11-7-5-9(13-3)10(14-4)6-8-12-2/h5-10,13-14H,1-2H2,3-4H3/b7-5-,8-6-
InChIKeyYKVHZSQFVAHSHR-SFECMWDFSA-N
XLogP0.59
TPSA48.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 (1Z,5Z)-3-N,4-N-dimethyl-1,6-bis(methylideneamino)hexa-1,5-diene-3,4-diamine?
The IUPAC name of (1Z,5Z)-3-N,4-N-dimethyl-1,6-bis(methylideneamino)hexa-1,5-diene-3,4-diamine (CID 138527605) is (1Z,5Z)-3-N,4-N-dimethyl-1,6-bis(methylideneamino)hexa-1,5-diene-3,4-diamine.
What is the SMILES notation for (1Z,5Z)-3-N,4-N-dimethyl-1,6-bis(methylideneamino)hexa-1,5-diene-3,4-diamine?
The canonical SMILES for (1Z,5Z)-3-N,4-N-dimethyl-1,6-bis(methylideneamino)hexa-1,5-diene-3,4-diamine is C=N/C=C\C(NC)C(/C=C\N=C)NC.
What is the InChIKey of (1Z,5Z)-3-N,4-N-dimethyl-1,6-bis(methylideneamino)hexa-1,5-diene-3,4-diamine?
The InChIKey is YKVHZSQFVAHSHR-SFECMWDFSA-N. The full InChI is InChI=1S/C10H18N4/c1-11-7-5-9(13-3)10(14-4)6-8-12-2/h5-10,13-14H,1-2H2,3-4H3/b7-5-,8-6-.
What are the key properties of (1Z,5Z)-3-N,4-N-dimethyl-1,6-bis(methylideneamino)hexa-1,5-diene-3,4-diamine?
(1Z,5Z)-3-N,4-N-dimethyl-1,6-bis(methylideneamino)hexa-1,5-diene-3,4-diamine has a molecular weight of 194.28 g/mol, XLogP of 0.59, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,5Z)-3-N,4-N-dimethyl-1,6-bis(methylideneamino)hexa-1,5-diene-3,4-diamine is sourced from PubChem (CID 138527605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).