6-methyl-N-prop-1-en-2-ylcyclohexa-1,5-dien-1-amine

C10H15N — CID 89092403

IUPAC6-methyl-N-prop-1-en-2-ylcyclohexa-1,5-dien-1-amine
SMILESC=C(C)NC1=CCCC=C1C
InChIInChI=1S/C10H15N/c1-8(2)11-10-7-5-4-6-9(10)3/h6-7,11H,1,4-5H2,2-3H3
InChIKeyWHFAFNUSFRYJAV-UHFFFAOYSA-N
MW149.24 g/mol
LogP2.73
Rot. Bonds2

About 6-methyl-N-prop-1-en-2-ylcyclohexa-1,5-dien-1-amine

6-methyl-N-prop-1-en-2-ylcyclohexa-1,5-dien-1-amine (PubChem CID 89092403) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is 6-methyl-N-prop-1-en-2-ylcyclohexa-1,5-dien-1-amine.

Molecular Properties

Compound Name6-methyl-N-prop-1-en-2-ylcyclohexa-1,5-dien-1-amine
PubChem CID89092403
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC Name6-methyl-N-prop-1-en-2-ylcyclohexa-1,5-dien-1-amine
SMILESC=C(C)NC1=CCCC=C1C
InChIInChI=1S/C10H15N/c1-8(2)11-10-7-5-4-6-9(10)3/h6-7,11H,1,4-5H2,2-3H3
InChIKeyWHFAFNUSFRYJAV-UHFFFAOYSA-N
XLogP2.73
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-prop-1-en-2-ylcyclohexa-1,5-dien-1-amine?
The IUPAC name of 6-methyl-N-prop-1-en-2-ylcyclohexa-1,5-dien-1-amine (CID 89092403) is 6-methyl-N-prop-1-en-2-ylcyclohexa-1,5-dien-1-amine.
What is the SMILES notation for 6-methyl-N-prop-1-en-2-ylcyclohexa-1,5-dien-1-amine?
The canonical SMILES for 6-methyl-N-prop-1-en-2-ylcyclohexa-1,5-dien-1-amine is C=C(C)NC1=CCCC=C1C.
What is the InChIKey of 6-methyl-N-prop-1-en-2-ylcyclohexa-1,5-dien-1-amine?
The InChIKey is WHFAFNUSFRYJAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N/c1-8(2)11-10-7-5-4-6-9(10)3/h6-7,11H,1,4-5H2,2-3H3.
What are the key properties of 6-methyl-N-prop-1-en-2-ylcyclohexa-1,5-dien-1-amine?
6-methyl-N-prop-1-en-2-ylcyclohexa-1,5-dien-1-amine has a molecular weight of 149.24 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-prop-1-en-2-ylcyclohexa-1,5-dien-1-amine is sourced from PubChem (CID 89092403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).