N,6-dimethylcyclohexa-2,4-dien-1-amine

C8H13N — CID 22084990

IUPACN,6-dimethylcyclohexa-2,4-dien-1-amine
SMILESCNC1C=CC=CC1C
InChIInChI=1S/C8H13N/c1-7-5-3-4-6-8(7)9-2/h3-9H,1-2H3
InChIKeyLHYMTFBKVHDFLH-UHFFFAOYSA-N
MW123.20 g/mol
LogP1.34
Rot. Bonds1

About N,6-dimethylcyclohexa-2,4-dien-1-amine

N,6-dimethylcyclohexa-2,4-dien-1-amine (PubChem CID 22084990) has the molecular formula C8H13N and a molecular weight of 123.20 g/mol. Its IUPAC name is N,6-dimethylcyclohexa-2,4-dien-1-amine.

Molecular Properties

Compound NameN,6-dimethylcyclohexa-2,4-dien-1-amine
PubChem CID22084990
Molecular FormulaC8H13N
Molecular Weight123.20 g/mol
Exact Mass123.10
IUPAC NameN,6-dimethylcyclohexa-2,4-dien-1-amine
SMILESCNC1C=CC=CC1C
InChIInChI=1S/C8H13N/c1-7-5-3-4-6-8(7)9-2/h3-9H,1-2H3
InChIKeyLHYMTFBKVHDFLH-UHFFFAOYSA-N
XLogP1.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.20
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Pyridine, 1,2,5,6-tetrahydro-5-isopropyl-
CID 23423760
3a,7a-dihydro-1H-indole
CID 20577477
Dihydrotoluidin
CID 89012782
2-(Cyclopenta-2,4-dien-1-yl)-N-methylethanamine
CID 12109886
4-fluoro-N,2-dimethylcyclohexa-2,4-dien-1-amine
CID 68241956
(E,2R)-4-fluoro-N-methyl-3-methylidenehex-4-en-2-amine
CID 117854387
5,6-difluoro-N-methylcyclohexa-2,4-dien-1-amine
CID 118423018
N'-(3-fluorocyclohexa-2,4-dien-1-yl)-2-methylpropane-1,3-diamine
CID 123514156
(6S)-4-fluoro-N,1,6-trimethylcyclohexa-2,4-dien-1-amine
CID 134365554
(5E)-6-fluoro-N,4-dimethylnona-1,5-dien-3-amine
CID 134365669
1-(4-fluorocyclohexa-2,4-dien-1-yl)-N-methylmethanamine
CID 138478275
2-fluoro-N,4-dimethylcyclohexa-2,4-dien-1-amine
CID 142875853

Frequently Asked Questions

What is the IUPAC name of N,6-dimethylcyclohexa-2,4-dien-1-amine?
The IUPAC name of N,6-dimethylcyclohexa-2,4-dien-1-amine (CID 22084990) is N,6-dimethylcyclohexa-2,4-dien-1-amine.
What is the SMILES notation for N,6-dimethylcyclohexa-2,4-dien-1-amine?
The canonical SMILES for N,6-dimethylcyclohexa-2,4-dien-1-amine is CNC1C=CC=CC1C.
What is the InChIKey of N,6-dimethylcyclohexa-2,4-dien-1-amine?
The InChIKey is LHYMTFBKVHDFLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N/c1-7-5-3-4-6-8(7)9-2/h3-9H,1-2H3.
What are the key properties of N,6-dimethylcyclohexa-2,4-dien-1-amine?
N,6-dimethylcyclohexa-2,4-dien-1-amine has a molecular weight of 123.20 g/mol, XLogP of 1.34, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethylcyclohexa-2,4-dien-1-amine is sourced from PubChem (CID 22084990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).