methyl-(2-methyl-5-methylazanidylcyclopenta-1,4-dien-1-yl)azanide

C8H12N2-2 — CID 58399761

IUPACmethyl-(2-methyl-5-methylazanidylcyclopenta-1,4-dien-1-yl)azanide
SMILESC[N-]C1=CCC(C)=C1[N-]C
InChIInChI=1S/C8H12N2/c1-6-4-5-7(9-2)8(6)10-3/h5H,4H2,1-3H3/q-2
InChIKeyRGFLBQNENQPOMV-UHFFFAOYSA-N
MW136.20 g/mol
LogP2.56
Rot. Bonds2

About methyl-(2-methyl-5-methylazanidylcyclopenta-1,4-dien-1-yl)azanide

methyl-(2-methyl-5-methylazanidylcyclopenta-1,4-dien-1-yl)azanide (PubChem CID 58399761) has the molecular formula C8H12N2-2 and a molecular weight of 136.20 g/mol. Its IUPAC name is methyl-(2-methyl-5-methylazanidylcyclopenta-1,4-dien-1-yl)azanide.

Molecular Properties

Compound Namemethyl-(2-methyl-5-methylazanidylcyclopenta-1,4-dien-1-yl)azanide
PubChem CID58399761
Molecular FormulaC8H12N2-2
Molecular Weight136.20 g/mol
Exact Mass136.10
IUPAC Namemethyl-(2-methyl-5-methylazanidylcyclopenta-1,4-dien-1-yl)azanide
SMILESC[N-]C1=CCC(C)=C1[N-]C
InChIInChI=1S/C8H12N2/c1-6-4-5-7(9-2)8(6)10-3/h5H,4H2,1-3H3/q-2
InChIKeyRGFLBQNENQPOMV-UHFFFAOYSA-N
XLogP2.56
TPSA28.20 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.20
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-N,1-N,3-N,3-N,2-pentamethylcyclopenta-1,3-diene-1,3-diamine
CID 22996625
1-N,2-N,3-trimethylcyclopenta-2,5-diene-1,2-diamine
CID 58399756
1-N,1-N,2-N,2-N,3-N,3-N-hexamethylcyclopenta-1,3-diene-1,2,3-triamine
CID 87388747
(4E,5E)-5-ethylidene-1-methyl-4-(2-methylpropylidene)triazole
CID 153347216
(4,5-Dimethylcyclopenta-1,4-dien-1-yl)-trimethylazanium
CID 174421081

Frequently Asked Questions

What is the IUPAC name of methyl-(2-methyl-5-methylazanidylcyclopenta-1,4-dien-1-yl)azanide?
The IUPAC name of methyl-(2-methyl-5-methylazanidylcyclopenta-1,4-dien-1-yl)azanide (CID 58399761) is methyl-(2-methyl-5-methylazanidylcyclopenta-1,4-dien-1-yl)azanide.
What is the SMILES notation for methyl-(2-methyl-5-methylazanidylcyclopenta-1,4-dien-1-yl)azanide?
The canonical SMILES for methyl-(2-methyl-5-methylazanidylcyclopenta-1,4-dien-1-yl)azanide is C[N-]C1=CCC(C)=C1[N-]C.
What is the InChIKey of methyl-(2-methyl-5-methylazanidylcyclopenta-1,4-dien-1-yl)azanide?
The InChIKey is RGFLBQNENQPOMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2/c1-6-4-5-7(9-2)8(6)10-3/h5H,4H2,1-3H3/q-2.
What are the key properties of methyl-(2-methyl-5-methylazanidylcyclopenta-1,4-dien-1-yl)azanide?
methyl-(2-methyl-5-methylazanidylcyclopenta-1,4-dien-1-yl)azanide has a molecular weight of 136.20 g/mol, XLogP of 2.56, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-(2-methyl-5-methylazanidylcyclopenta-1,4-dien-1-yl)azanide is sourced from PubChem (CID 58399761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).