(6-methylcyclohepta-2,4-dien-1-yl)methanamine

C9H15N — CID 143359820

IUPAC(6-methylcyclohepta-2,4-dien-1-yl)methanamine
SMILESCC1C=CC=CC(CN)C1
InChIInChI=1S/C9H15N/c1-8-4-2-3-5-9(6-8)7-10/h2-5,8-9H,6-7,10H2,1H3
InChIKeySEMQBPNNYDCSBX-UHFFFAOYSA-N
MW137.23 g/mol
LogP1.71
Rot. Bonds1

About (6-methylcyclohepta-2,4-dien-1-yl)methanamine

(6-methylcyclohepta-2,4-dien-1-yl)methanamine (PubChem CID 143359820) has the molecular formula C9H15N and a molecular weight of 137.23 g/mol. Its IUPAC name is (6-methylcyclohepta-2,4-dien-1-yl)methanamine.

Molecular Properties

Compound Name(6-methylcyclohepta-2,4-dien-1-yl)methanamine
PubChem CID143359820
Molecular FormulaC9H15N
Molecular Weight137.23 g/mol
Exact Mass137.12
IUPAC Name(6-methylcyclohepta-2,4-dien-1-yl)methanamine
SMILESCC1C=CC=CC(CN)C1
InChIInChI=1S/C9H15N/c1-8-4-2-3-5-9(6-8)7-10/h2-5,8-9H,6-7,10H2,1H3
InChIKeySEMQBPNNYDCSBX-UHFFFAOYSA-N
XLogP1.71
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.23
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[5-(aminomethyl)cyclohex-3-en-1-yl]methanamine
CID 153322157
[(1S,4R)-4-(aminomethyl)cyclopent-2-en-1-yl]methyl acetate
CID 10877544
(4-methylcyclopent-2-en-1-yl)iodanium
CID 171633953
cyclopenta-2,4-dien-1-ylmethanamine
CID 15412227
(2,4-dimethylcyclopentyl)methanamine
CID 134314260
cyclopent-2-en-1-ylmethanamine
CID 13040869
3-cyclohexa-2,4-dien-1-yl-2-methylpropan-1-amine
CID 142554560
ethyl-methyl-[(4-methylcyclopent-2-en-1-yl)methylsulfanyl]-(2-methylcyclopropyl)-λ4-sulfane
CID 134387798
4-[(4-methylcyclopent-2-en-1-yl)methyl]morpholine
CID 118198411
(1S)-5-methylcyclohex-3-en-1-amine
CID 175324553
2-[(2S)-2-methylcyclopropyl]ethanamine
CID 154557552
[(3R,5R)-3,5-dimethylcyclohexyl]methanamine
CID 124506919

Frequently Asked Questions

What is the IUPAC name of (6-methylcyclohepta-2,4-dien-1-yl)methanamine?
The IUPAC name of (6-methylcyclohepta-2,4-dien-1-yl)methanamine (CID 143359820) is (6-methylcyclohepta-2,4-dien-1-yl)methanamine.
What is the SMILES notation for (6-methylcyclohepta-2,4-dien-1-yl)methanamine?
The canonical SMILES for (6-methylcyclohepta-2,4-dien-1-yl)methanamine is CC1C=CC=CC(CN)C1.
What is the InChIKey of (6-methylcyclohepta-2,4-dien-1-yl)methanamine?
The InChIKey is SEMQBPNNYDCSBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N/c1-8-4-2-3-5-9(6-8)7-10/h2-5,8-9H,6-7,10H2,1H3.
What are the key properties of (6-methylcyclohepta-2,4-dien-1-yl)methanamine?
(6-methylcyclohepta-2,4-dien-1-yl)methanamine has a molecular weight of 137.23 g/mol, XLogP of 1.71, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methylcyclohepta-2,4-dien-1-yl)methanamine is sourced from PubChem (CID 143359820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).