N-ethenyl-4-ethylcyclohexa-1,5-dien-1-amine

C10H15N — CID 146639726

IUPACN-ethenyl-4-ethylcyclohexa-1,5-dien-1-amine
SMILESC=CNC1=CCC(CC)C=C1
InChIInChI=1S/C10H15N/c1-3-9-5-7-10(8-6-9)11-4-2/h4-5,7-9,11H,2-3,6H2,1H3
InChIKeyITQSBLRDWNEACA-UHFFFAOYSA-N
MW149.24 g/mol
LogP2.59
Rot. Bonds3

About N-ethenyl-4-ethylcyclohexa-1,5-dien-1-amine

N-ethenyl-4-ethylcyclohexa-1,5-dien-1-amine (PubChem CID 146639726) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is N-ethenyl-4-ethylcyclohexa-1,5-dien-1-amine.

Molecular Properties

Compound NameN-ethenyl-4-ethylcyclohexa-1,5-dien-1-amine
PubChem CID146639726
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC NameN-ethenyl-4-ethylcyclohexa-1,5-dien-1-amine
SMILESC=CNC1=CCC(CC)C=C1
InChIInChI=1S/C10H15N/c1-3-9-5-7-10(8-6-9)11-4-2/h4-5,7-9,11H,2-3,6H2,1H3
InChIKeyITQSBLRDWNEACA-UHFFFAOYSA-N
XLogP2.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-N-ethenyl-1-N-ethyl-1-N-[2-[(4-ethylcyclohexa-1,5-dien-1-yl)amino]ethyl]-4-N-methylcyclohexa-1,5-diene-1,4-diamine
CID 146478036
(4-ethylcyclohexa-1,5-dien-1-yl)benzene
CID 143614396
4-(4-ethylcyclohexa-1,5-dien-1-yl)benzonitrile
CID 19005543
(Z)-1-(4-ethylcyclohexa-1,5-dien-1-yl)-N-methyl-1-methylsulfanylprop-1-en-2-amine
CID 154693277
7-N'-(4-ethylcyclohexa-1,5-dien-1-yl)-2-N',2-N',7-N'-tris(4-ethylphenyl)-9,9'-spirobi[fluorene]-2',7'-diamine
CID 123491355
(NE)-N-[[(1Z,5Z,7Z)-4-ethylcycloocta-1,5,7-trien-1-yl]methylidene]hydroxylamine
CID 170152478
9-(4-ethylcyclohexa-1,5-dien-1-yl)carbazole
CID 123432152
6-ethyl-5-(4-ethylcyclohexa-1,5-dien-1-yl)-2-methylcyclohexa-1,3-diene
CID 123833108
N'-(4-but-1-en-2-ylcyclohexa-1,5-dien-1-yl)-N-methylmethanediamine
CID 178080661
methyl 4-(ethenylamino)-6,6-diethylcyclohexa-2,4-diene-1-carboxylate
CID 174407472
N-methyl-1-[(1R)-4-propan-2-ylcyclohexa-2,4-dien-1-yl]methanamine
CID 137439340
(E)-2-[2-[(4-ethylcyclohexa-1,5-dien-1-yl)methylimino]ethyl]pent-2-enal
CID 142913270

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-4-ethylcyclohexa-1,5-dien-1-amine?
The IUPAC name of N-ethenyl-4-ethylcyclohexa-1,5-dien-1-amine (CID 146639726) is N-ethenyl-4-ethylcyclohexa-1,5-dien-1-amine.
What is the SMILES notation for N-ethenyl-4-ethylcyclohexa-1,5-dien-1-amine?
The canonical SMILES for N-ethenyl-4-ethylcyclohexa-1,5-dien-1-amine is C=CNC1=CCC(CC)C=C1.
What is the InChIKey of N-ethenyl-4-ethylcyclohexa-1,5-dien-1-amine?
The InChIKey is ITQSBLRDWNEACA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N/c1-3-9-5-7-10(8-6-9)11-4-2/h4-5,7-9,11H,2-3,6H2,1H3.
What are the key properties of N-ethenyl-4-ethylcyclohexa-1,5-dien-1-amine?
N-ethenyl-4-ethylcyclohexa-1,5-dien-1-amine has a molecular weight of 149.24 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-4-ethylcyclohexa-1,5-dien-1-amine is sourced from PubChem (CID 146639726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).