N,N,4-trimethylbicyclo[4.1.0]hepta-2,4-dien-1-amine

C10H15N — CID 176947266

IUPACN,N,4-trimethylbicyclo[4.1.0]hepta-2,4-dien-1-amine
SMILESCC1=CC2CC2(N(C)C)C=C1
InChIInChI=1S/C10H15N/c1-8-4-5-10(11(2)3)7-9(10)6-8/h4-6,9H,7H2,1-3H3
InChIKeyGZKGJKPYYBJWFI-UHFFFAOYSA-N
MW149.24 g/mol
LogP1.82
Rot. Bonds1

About N,N,4-trimethylbicyclo[4.1.0]hepta-2,4-dien-1-amine

N,N,4-trimethylbicyclo[4.1.0]hepta-2,4-dien-1-amine (PubChem CID 176947266) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is N,N,4-trimethylbicyclo[4.1.0]hepta-2,4-dien-1-amine.

Molecular Properties

Compound NameN,N,4-trimethylbicyclo[4.1.0]hepta-2,4-dien-1-amine
PubChem CID176947266
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC NameN,N,4-trimethylbicyclo[4.1.0]hepta-2,4-dien-1-amine
SMILESCC1=CC2CC2(N(C)C)C=C1
InChIInChI=1S/C10H15N/c1-8-4-5-10(11(2)3)7-9(10)6-8/h4-6,9H,7H2,1-3H3
InChIKeyGZKGJKPYYBJWFI-UHFFFAOYSA-N
XLogP1.82
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-fluoro-4-methylbicyclo[4.1.0]hepta-2,4-diene
CID 143532130
N-ethyl-2-methoxy-N-[(4-methyl-1-bicyclo[4.1.0]hepta-2,4-dienyl)methyl]ethanamine
CID 144717930
N,N-dimethyl-1-(4-methyl-1-bicyclo[4.1.0]hepta-2,4-dienyl)-1-(4-methylcyclohepta-1,3,6-trien-1-yl)methanamine
CID 142069182
6-N-(4-methyl-1-bicyclo[4.1.0]hepta-2,4-dienyl)-3-N,3-N,6-N-tris(4-methylphenyl)-9,9a-dihydro-4aH-carbazole-3,6-diamine
CID 142304346
1-(4-methyl-1-bicyclo[4.1.0]hepta-2,4-dienyl)-1,2,4-triazole
CID 142207384
3,6-dimethyl-6-sulfanylcyclohexa-2,4-dien-1-ol
CID 87698973
N-[4-(4-methylphenyl)phenyl]-4-phenyl-N-(4-phenylphenyl)bicyclo[4.1.0]hepta-2,4-dien-1-amine
CID 144619494
6-tert-butyl-3,6-dimethylcyclohexa-2,4-dien-1-ol
CID 23160401
N,N,3-trimethylcyclohexa-2,4-dien-1-amine
CID 118506281
1,4-dimethylcyclohexa-3,5-diene-1,2-diamine
CID 53423794
1,4,6-trimethylcyclohexa-2,4-dien-1-amine
CID 68727939
6-fluoro-1,4-dimethylcyclohexa-2,4-dien-1-ol
CID 174534272

Frequently Asked Questions

What is the IUPAC name of N,N,4-trimethylbicyclo[4.1.0]hepta-2,4-dien-1-amine?
The IUPAC name of N,N,4-trimethylbicyclo[4.1.0]hepta-2,4-dien-1-amine (CID 176947266) is N,N,4-trimethylbicyclo[4.1.0]hepta-2,4-dien-1-amine.
What is the SMILES notation for N,N,4-trimethylbicyclo[4.1.0]hepta-2,4-dien-1-amine?
The canonical SMILES for N,N,4-trimethylbicyclo[4.1.0]hepta-2,4-dien-1-amine is CC1=CC2CC2(N(C)C)C=C1.
What is the InChIKey of N,N,4-trimethylbicyclo[4.1.0]hepta-2,4-dien-1-amine?
The InChIKey is GZKGJKPYYBJWFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N/c1-8-4-5-10(11(2)3)7-9(10)6-8/h4-6,9H,7H2,1-3H3.
What are the key properties of N,N,4-trimethylbicyclo[4.1.0]hepta-2,4-dien-1-amine?
N,N,4-trimethylbicyclo[4.1.0]hepta-2,4-dien-1-amine has a molecular weight of 149.24 g/mol, XLogP of 1.82, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4-trimethylbicyclo[4.1.0]hepta-2,4-dien-1-amine is sourced from PubChem (CID 176947266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).