N,N-dimethyl-5-methylidenecyclopenta-1,3-dien-1-amine

C8H11N — CID 90007951

IUPACN,N-dimethyl-5-methylidenecyclopenta-1,3-dien-1-amine
SMILESC=C1C=CC=C1N(C)C
InChIInChI=1S/C8H11N/c1-7-5-4-6-8(7)9(2)3/h4-6H,1H2,2-3H3
InChIKeyNZDSCJUHZRIRHH-UHFFFAOYSA-N
MW121.18 g/mol
LogP1.56
Rot. Bonds1

About N,N-dimethyl-5-methylidenecyclopenta-1,3-dien-1-amine

N,N-dimethyl-5-methylidenecyclopenta-1,3-dien-1-amine (PubChem CID 90007951) has the molecular formula C8H11N and a molecular weight of 121.18 g/mol. Its IUPAC name is N,N-dimethyl-5-methylidenecyclopenta-1,3-dien-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-5-methylidenecyclopenta-1,3-dien-1-amine
PubChem CID90007951
Molecular FormulaC8H11N
Molecular Weight121.18 g/mol
Exact Mass121.09
IUPAC NameN,N-dimethyl-5-methylidenecyclopenta-1,3-dien-1-amine
SMILESC=C1C=CC=C1N(C)C
InChIInChI=1S/C8H11N/c1-7-5-4-6-8(7)9(2)3/h4-6H,1H2,2-3H3
InChIKeyNZDSCJUHZRIRHH-UHFFFAOYSA-N
XLogP1.56
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.18
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Pentalene, 1,3-bis(dimethylamino)-
CID 139825
Ethanamine, 1-(2,4-cyclopentadien-1-ylidene)-N,N-dimethyl-
CID 585126
2-(Cyclopenta-2,4-dien-1-ylidene)-1-methyl-1,2-dihydropyridine
CID 13860310
(E)-6-[2-(dimethylamino)ethenyl]-fulvene
CID 13280603
N,N-dimethylcyclopenta-1,4-dien-1-amine
CID 17775259
(2E,3E)-3-(1-fluoroethylidene)-1,5-dimethyl-2-propylidenepyrrole
CID 144831865
3-(fluoromethyl)-1,2-dimethyl-5-methylidene-2H-pyrrole
CID 146290476
(3E,4E)-N-fluoro-N,5-dimethyl-3-propylidenehepta-1,4-dien-2-amine
CID 155001788
(2E,3Z)-3-ethylidene-2-(2-fluoroprop-2-enylidene)-1,5-dimethylpyrrole
CID 167047016
2-Cyclopenta-2,4-dien-1-ylidenepyridin-1-ide
CID 11987190
1-(Cyclopenta-2,4-dien-1-ylidene)-N,N-diethylethan-1-amine
CID 45088785
Bis(diethylamino)fulvene
CID 129655938

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-methylidenecyclopenta-1,3-dien-1-amine?
The IUPAC name of N,N-dimethyl-5-methylidenecyclopenta-1,3-dien-1-amine (CID 90007951) is N,N-dimethyl-5-methylidenecyclopenta-1,3-dien-1-amine.
What is the SMILES notation for N,N-dimethyl-5-methylidenecyclopenta-1,3-dien-1-amine?
The canonical SMILES for N,N-dimethyl-5-methylidenecyclopenta-1,3-dien-1-amine is C=C1C=CC=C1N(C)C.
What is the InChIKey of N,N-dimethyl-5-methylidenecyclopenta-1,3-dien-1-amine?
The InChIKey is NZDSCJUHZRIRHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N/c1-7-5-4-6-8(7)9(2)3/h4-6H,1H2,2-3H3.
What are the key properties of N,N-dimethyl-5-methylidenecyclopenta-1,3-dien-1-amine?
N,N-dimethyl-5-methylidenecyclopenta-1,3-dien-1-amine has a molecular weight of 121.18 g/mol, XLogP of 1.56, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-5-methylidenecyclopenta-1,3-dien-1-amine is sourced from PubChem (CID 90007951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).