(4E,7Z)-1-N,1-N,5-N,5-N-tetramethylcycloocta-1,2,4,7-tetraene-1,5-diamine

C12H18N2 — CID 142992167

IUPAC(4E,7Z)-1-N,1-N,5-N,5-N-tetramethylcycloocta-1,2,4,7-tetraene-1,5-diamine
SMILESCN(C)C1=C=C/C=C(/N(C)C)C/C=C\1
InChIInChI=1S/C12H18N2/c1-13(2)11-7-5-9-12(14(3)4)10-6-8-11/h5-7,10H,8H2,1-4H3/b10-6-,11-7+
InChIKeyQNTVFYNPWBFYSI-NAKBGQTNSA-N
MW190.29 g/mol
LogP1.99
Rot. Bonds2

About (4E,7Z)-1-N,1-N,5-N,5-N-tetramethylcycloocta-1,2,4,7-tetraene-1,5-diamine

(4E,7Z)-1-N,1-N,5-N,5-N-tetramethylcycloocta-1,2,4,7-tetraene-1,5-diamine (PubChem CID 142992167) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is (4E,7Z)-1-N,1-N,5-N,5-N-tetramethylcycloocta-1,2,4,7-tetraene-1,5-diamine.

Molecular Properties

Compound Name(4E,7Z)-1-N,1-N,5-N,5-N-tetramethylcycloocta-1,2,4,7-tetraene-1,5-diamine
PubChem CID142992167
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name(4E,7Z)-1-N,1-N,5-N,5-N-tetramethylcycloocta-1,2,4,7-tetraene-1,5-diamine
SMILESCN(C)C1=C=C/C=C(/N(C)C)C/C=C\1
InChIInChI=1S/C12H18N2/c1-13(2)11-7-5-9-12(14(3)4)10-6-8-11/h5-7,10H,8H2,1-4H3/b10-6-,11-7+
InChIKeyQNTVFYNPWBFYSI-NAKBGQTNSA-N
XLogP1.99
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (4E,7Z)-1-N,1-N,5-N,5-N-tetramethylcycloocta-1,2,4,7-tetraene-1,5-diamine with MolForge

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Related Compounds

Pentalene, 1,3-bis(dimethylamino)-
CID 139825
N,N-dimethylcyclopenta-1,4-dien-1-amine
CID 17775259
Dimethylaminofulvene
CID 90007951
N,N-dimethylcyclopenta-1,3-dien-1-amine
CID 12679267
(3E)-N,N-dimethylhexa-3,5-dien-3-amine
CID 13112058
N,N-dimethylcyclohepta-1,3,5-trien-1-amine
CID 13380462
N,N-dimethylcyclohexa-1,5-dien-1-amine
CID 21647338
1,6-diethyl-2H-pyridine
CID 22064883
6-ethyl-1-propan-2-yl-2H-pyridine
CID 22064953
1-N,1-N,3-N,3-N-tetramethylcyclohexa-1,3-diene-1,3-diamine
CID 22171086
1-N,1-N,3-N,3-N,2-pentamethylcyclopenta-1,3-diene-1,3-diamine
CID 22996625
1-N,1-N,3-N,3-N-tetramethylcyclopenta-1,3-diene-1,3-diamine
CID 22996630

Frequently Asked Questions

What is the IUPAC name of (4E,7Z)-1-N,1-N,5-N,5-N-tetramethylcycloocta-1,2,4,7-tetraene-1,5-diamine?
The IUPAC name of (4E,7Z)-1-N,1-N,5-N,5-N-tetramethylcycloocta-1,2,4,7-tetraene-1,5-diamine (CID 142992167) is (4E,7Z)-1-N,1-N,5-N,5-N-tetramethylcycloocta-1,2,4,7-tetraene-1,5-diamine.
What is the SMILES notation for (4E,7Z)-1-N,1-N,5-N,5-N-tetramethylcycloocta-1,2,4,7-tetraene-1,5-diamine?
The canonical SMILES for (4E,7Z)-1-N,1-N,5-N,5-N-tetramethylcycloocta-1,2,4,7-tetraene-1,5-diamine is CN(C)C1=C=C/C=C(/N(C)C)C/C=C\1.
What is the InChIKey of (4E,7Z)-1-N,1-N,5-N,5-N-tetramethylcycloocta-1,2,4,7-tetraene-1,5-diamine?
The InChIKey is QNTVFYNPWBFYSI-NAKBGQTNSA-N. The full InChI is InChI=1S/C12H18N2/c1-13(2)11-7-5-9-12(14(3)4)10-6-8-11/h5-7,10H,8H2,1-4H3/b10-6-,11-7+.
What are the key properties of (4E,7Z)-1-N,1-N,5-N,5-N-tetramethylcycloocta-1,2,4,7-tetraene-1,5-diamine?
(4E,7Z)-1-N,1-N,5-N,5-N-tetramethylcycloocta-1,2,4,7-tetraene-1,5-diamine has a molecular weight of 190.29 g/mol, XLogP of 1.99, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4E,7Z)-1-N,1-N,5-N,5-N-tetramethylcycloocta-1,2,4,7-tetraene-1,5-diamine is sourced from PubChem (CID 142992167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).