N,N,N',N'-tetramethyl-1-(3-methylcyclopenta-2,4-dien-1-ylidene)methanediamine

C11H18N2 — CID 134988622

IUPACN,N,N',N'-tetramethyl-1-(3-methylcyclopenta-2,4-dien-1-ylidene)methanediamine
SMILESCC1=CC(=C(N(C)C)N(C)C)C=C1
InChIInChI=1S/C11H18N2/c1-9-6-7-10(8-9)11(12(2)3)13(4)5/h6-8H,1-5H3
InChIKeySPXQYRNYOPMBHM-UHFFFAOYSA-N
MW178.28 g/mol
LogP1.84
Rot. Bonds2

About N,N,N',N'-tetramethyl-1-(3-methylcyclopenta-2,4-dien-1-ylidene)methanediamine

N,N,N',N'-tetramethyl-1-(3-methylcyclopenta-2,4-dien-1-ylidene)methanediamine (PubChem CID 134988622) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is N,N,N',N'-tetramethyl-1-(3-methylcyclopenta-2,4-dien-1-ylidene)methanediamine.

Molecular Properties

Compound NameN,N,N',N'-tetramethyl-1-(3-methylcyclopenta-2,4-dien-1-ylidene)methanediamine
PubChem CID134988622
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC NameN,N,N',N'-tetramethyl-1-(3-methylcyclopenta-2,4-dien-1-ylidene)methanediamine
SMILESCC1=CC(=C(N(C)C)N(C)C)C=C1
InChIInChI=1S/C11H18N2/c1-9-6-7-10(8-9)11(12(2)3)13(4)5/h6-8H,1-5H3
InChIKeySPXQYRNYOPMBHM-UHFFFAOYSA-N
XLogP1.84
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6,6-Bis(dimethylamino)fulvene
CID 283350
1-cyclohepta-2,4,6-trien-1-ylidene-N,N,N',N'-tetramethylmethanediamine
CID 639401
1-[(2Z,4Z,6Z,8Z)-cyclonona-2,4,6,8-tetraen-1-ylidene]-N,N,N',N'-tetramethylmethanediamine
CID 12824843
1-(3-tert-butylcyclopenta-2,4-dien-1-ylidene)-N,N,N',N'-tetramethylmethanediamine
CID 13280633
1-[(2Z,4Z,6Z,8Z)-cyclonona-2,4,6,8-tetraen-1-ylidene]-N',N'-diethyl-N,N-dimethylmethanediamine
CID 13484281
2-Cyclopenta-2,4-dien-1-ylidene-1,3,4,5-tetramethylimidazole
CID 102029175
1-cyclopenta-2,4-dien-1-ylidene-N,N'-dimethyl-N,N'-di(propan-2-yl)methanediamine
CID 134923505
1-(3-ethylcyclopenta-2,4-dien-1-ylidene)-N,N,N',N'-tetramethylmethanediamine
CID 134923752
1-cyclopenta-2,4-dien-1-ylidene-N,N-dimethyl-N',N'-di(propan-2-yl)methanediamine
CID 134923776
1-(3-chlorocyclohexa-2,4-dien-1-ylidene)-N,N,N',N'-tetramethylmethanediamine
CID 141090048
1-cyclohexa-2,4-dien-1-ylidene-N,N,N',N'-tetramethylmethanediamine
CID 141201028
N,N,1,4,5-pentamethyl-2H-pyridin-6-amine
CID 150852892

Frequently Asked Questions

What is the IUPAC name of N,N,N',N'-tetramethyl-1-(3-methylcyclopenta-2,4-dien-1-ylidene)methanediamine?
The IUPAC name of N,N,N',N'-tetramethyl-1-(3-methylcyclopenta-2,4-dien-1-ylidene)methanediamine (CID 134988622) is N,N,N',N'-tetramethyl-1-(3-methylcyclopenta-2,4-dien-1-ylidene)methanediamine.
What is the SMILES notation for N,N,N',N'-tetramethyl-1-(3-methylcyclopenta-2,4-dien-1-ylidene)methanediamine?
The canonical SMILES for N,N,N',N'-tetramethyl-1-(3-methylcyclopenta-2,4-dien-1-ylidene)methanediamine is CC1=CC(=C(N(C)C)N(C)C)C=C1.
What is the InChIKey of N,N,N',N'-tetramethyl-1-(3-methylcyclopenta-2,4-dien-1-ylidene)methanediamine?
The InChIKey is SPXQYRNYOPMBHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2/c1-9-6-7-10(8-9)11(12(2)3)13(4)5/h6-8H,1-5H3.
What are the key properties of N,N,N',N'-tetramethyl-1-(3-methylcyclopenta-2,4-dien-1-ylidene)methanediamine?
N,N,N',N'-tetramethyl-1-(3-methylcyclopenta-2,4-dien-1-ylidene)methanediamine has a molecular weight of 178.28 g/mol, XLogP of 1.84, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,N',N'-tetramethyl-1-(3-methylcyclopenta-2,4-dien-1-ylidene)methanediamine is sourced from PubChem (CID 134988622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).