3,4-diethylcyclohexa-1,3-dien-1-amine

C10H17N — CID 143938092

IUPAC3,4-diethylcyclohexa-1,3-dien-1-amine
SMILESCCC1=C(CC)CCC(N)=C1
InChIInChI=1S/C10H17N/c1-3-8-5-6-10(11)7-9(8)4-2/h7H,3-6,11H2,1-2H3
InChIKeyGUGITKJDUPQKIG-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.74
Rot. Bonds2

About 3,4-diethylcyclohexa-1,3-dien-1-amine

3,4-diethylcyclohexa-1,3-dien-1-amine (PubChem CID 143938092) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 3,4-diethylcyclohexa-1,3-dien-1-amine.

Molecular Properties

Compound Name3,4-diethylcyclohexa-1,3-dien-1-amine
PubChem CID143938092
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name3,4-diethylcyclohexa-1,3-dien-1-amine
SMILESCCC1=C(CC)CCC(N)=C1
InChIInChI=1S/C10H17N/c1-3-8-5-6-10(11)7-9(8)4-2/h7H,3-6,11H2,1-2H3
InChIKeyGUGITKJDUPQKIG-UHFFFAOYSA-N
XLogP2.74
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,2,4,5-tetraethylcyclohepta-1,3,5-triene
CID 153389837
2-ethylcycloocta-1,3,5-trien-1-amine
CID 67050807
2,4-dichloro-1-ethylcyclohexa-1,3-diene
CID 19096890
1-ethyl-2,4-difluorocyclohexa-1,3-diene
CID 142010109
3,4-diethoxycyclohexa-1,3-dien-1-amine
CID 165130299
1-(3-butyl-4-ethylcyclohexa-1,3-dien-1-yl)butan-2-amine
CID 144895142
2-ethylcyclohexa-1,5-dien-1-amine
CID 143824141
4-bromo-1-ethyl-2-methylcyclohexa-1,3-diene
CID 144960407
3-ethyl-5,5-dimethyl-4-phenylcyclohexa-1,3-dien-1-amine
CID 159393837
3,4-diethyl-2,5-dihydrotellurophene
CID 19855763
7-ethyl-5,6-dihydro-1H-indol-4-amine
CID 129236666
4-propan-2-ylcyclohexa-1,3-diene-1,3-diamine
CID 146506417

Frequently Asked Questions

What is the IUPAC name of 3,4-diethylcyclohexa-1,3-dien-1-amine?
The IUPAC name of 3,4-diethylcyclohexa-1,3-dien-1-amine (CID 143938092) is 3,4-diethylcyclohexa-1,3-dien-1-amine.
What is the SMILES notation for 3,4-diethylcyclohexa-1,3-dien-1-amine?
The canonical SMILES for 3,4-diethylcyclohexa-1,3-dien-1-amine is CCC1=C(CC)CCC(N)=C1.
What is the InChIKey of 3,4-diethylcyclohexa-1,3-dien-1-amine?
The InChIKey is GUGITKJDUPQKIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-3-8-5-6-10(11)7-9(8)4-2/h7H,3-6,11H2,1-2H3.
What are the key properties of 3,4-diethylcyclohexa-1,3-dien-1-amine?
3,4-diethylcyclohexa-1,3-dien-1-amine has a molecular weight of 151.25 g/mol, XLogP of 2.74, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-diethylcyclohexa-1,3-dien-1-amine is sourced from PubChem (CID 143938092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).