6-methyl-N-propan-2-ylcyclohexa-1,3-dien-1-amine

C10H17N — CID 89319283

IUPAC6-methyl-N-propan-2-ylcyclohexa-1,3-dien-1-amine
SMILESCC(C)NC1=CC=CCC1C
InChIInChI=1S/C10H17N/c1-8(2)11-10-7-5-4-6-9(10)3/h4-5,7-9,11H,6H2,1-3H3
InChIKeyWLBDIMYOYMAIDX-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.46
Rot. Bonds2

About 6-methyl-N-propan-2-ylcyclohexa-1,3-dien-1-amine

6-methyl-N-propan-2-ylcyclohexa-1,3-dien-1-amine (PubChem CID 89319283) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 6-methyl-N-propan-2-ylcyclohexa-1,3-dien-1-amine.

Molecular Properties

Compound Name6-methyl-N-propan-2-ylcyclohexa-1,3-dien-1-amine
PubChem CID89319283
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name6-methyl-N-propan-2-ylcyclohexa-1,3-dien-1-amine
SMILESCC(C)NC1=CC=CCC1C
InChIInChI=1S/C10H17N/c1-8(2)11-10-7-5-4-6-9(10)3/h4-5,7-9,11H,6H2,1-3H3
InChIKeyWLBDIMYOYMAIDX-UHFFFAOYSA-N
XLogP2.46
TPSA12.03 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 ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-Dihydro-2,4-dihydro-2,4,6-tri-methylpyridine
CID 21326805
2-[(Z)-1-fluorobut-1-enyl]-3a,7a-dihydro-1H-indole
CID 68403127
4-fluoro-N,6-dimethylcyclohexa-1,3-dien-1-amine
CID 89357788
(Z,3Z)-7-fluoro-7-methyl-N-prop-1-en-2-yl-3-prop-2-enylideneoct-4-en-1-amine
CID 134302585
3,5-difluoro-N-[(2E,4E,6Z)-5-propan-2-ylocta-2,4,6-trien-3-yl]cyclohexa-2,4-dien-1-amine
CID 134406911
2-fluoro-1-N,2-dimethylcyclohexa-3,5-diene-1,3-diamine
CID 154997179
(3S)-5-fluoro-3,4-dimethyl-N-(2-methylpropyl)cyclohexa-1,5-dien-1-amine
CID 156226930
(3Z,6E,7Z,9Z)-N,8-diethyl-6-ethylidene-2-fluoro-5-methylundeca-3,7,9-trien-3-amine
CID 166651598
4-fluoro-6-methyl-N-propan-2-ylcyclohexa-2,4-dien-1-amine
CID 166888372
N-[(Z)-but-2-en-2-yl]-6-ethyl-4-(trifluoromethyl)cyclohexa-2,4-dien-1-amine
CID 167216752
2-Propan-2-yl-6-(trifluoromethyl)-1,2-dihydropyridine
CID 169163722
(1Z,3Z)-N-(3-fluoro-4-methylpenta-1,4-dien-2-yl)-2-propan-2-ylpenta-1,3-dien-1-amine
CID 173982628

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-propan-2-ylcyclohexa-1,3-dien-1-amine?
The IUPAC name of 6-methyl-N-propan-2-ylcyclohexa-1,3-dien-1-amine (CID 89319283) is 6-methyl-N-propan-2-ylcyclohexa-1,3-dien-1-amine.
What is the SMILES notation for 6-methyl-N-propan-2-ylcyclohexa-1,3-dien-1-amine?
The canonical SMILES for 6-methyl-N-propan-2-ylcyclohexa-1,3-dien-1-amine is CC(C)NC1=CC=CCC1C.
What is the InChIKey of 6-methyl-N-propan-2-ylcyclohexa-1,3-dien-1-amine?
The InChIKey is WLBDIMYOYMAIDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-8(2)11-10-7-5-4-6-9(10)3/h4-5,7-9,11H,6H2,1-3H3.
What are the key properties of 6-methyl-N-propan-2-ylcyclohexa-1,3-dien-1-amine?
6-methyl-N-propan-2-ylcyclohexa-1,3-dien-1-amine has a molecular weight of 151.25 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-propan-2-ylcyclohexa-1,3-dien-1-amine is sourced from PubChem (CID 89319283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).