2-methyl-1,1a-dihydrocyclopropa[d]quinoline

C11H11N — CID 142233469

IUPAC2-methyl-1,1a-dihydrocyclopropa[d]quinoline
SMILESCC1=CN=C2C=CC=CC23CC13
InChIInChI=1S/C11H11N/c1-8-7-12-10-4-2-3-5-11(10)6-9(8)11/h2-5,7,9H,6H2,1H3
InChIKeyLRFHPBRKVMKBNQ-UHFFFAOYSA-N
MW157.22 g/mol
LogP2.48
Rot. Bonds

About 2-methyl-1,1a-dihydrocyclopropa[d]quinoline

2-methyl-1,1a-dihydrocyclopropa[d]quinoline (PubChem CID 142233469) has the molecular formula C11H11N and a molecular weight of 157.22 g/mol. Its IUPAC name is 2-methyl-1,1a-dihydrocyclopropa[d]quinoline.

Molecular Properties

Compound Name2-methyl-1,1a-dihydrocyclopropa[d]quinoline
PubChem CID142233469
Molecular FormulaC11H11N
Molecular Weight157.22 g/mol
Exact Mass157.09
IUPAC Name2-methyl-1,1a-dihydrocyclopropa[d]quinoline
SMILESCC1=CN=C2C=CC=CC23CC13
InChIInChI=1S/C11H11N/c1-8-7-12-10-4-2-3-5-11(10)6-9(8)11/h2-5,7,9H,6H2,1H3
InChIKeyLRFHPBRKVMKBNQ-UHFFFAOYSA-N
XLogP2.48
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.22
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(6E)-6-[1-(1-butan-2-ylcyclopropyl)ethylidene]-N-[(E)-but-1-enyl]-3-fluorocyclohexa-2,4-dien-1-imine
CID 176962639
4,4-dimethyl-4aH-quinoline
CID 68272822
12-Azatetracyclo[12.4.0.01,6.06,11]octadeca-2,4,7,9,11,13,15,17-octaene
CID 69134422
N-[(Z)-2-methylbut-1-enyl]-1-[2-(3-methylhex-4-en-3-yl)-2,3-dihydronaphthalen-1-yl]propan-1-imine
CID 130178634
N-[(Z)-2-methylbut-1-enyl]-1-(2-pent-2-enyl-2,3-dihydronaphthalen-1-yl)propan-1-imine
CID 132192244
1-[6-(2,3-Dimethyl-1-prop-1-enylcyclopropyl)cyclohexa-1,3-dien-1-yl]-6-methyl-6,7-dihydroisoquinoline
CID 134249844
1-[6-(2-Methyl-1-prop-1-enylcyclopropyl)cyclohexa-1,3-dien-1-yl]-4a,8a-dihydroisoquinoline
CID 134286196
1-[3-Methyl-6-(2-methyl-1-prop-1-enylcyclopropyl)cyclohexa-1,3-dien-1-yl]-4a,8a-dihydroisoquinoline
CID 139469815
2-[(1Z)-1-cyclohexa-2,4-dien-1-ylidene-2-(2-methyl-1-prop-1-enylcyclopropyl)pent-4-enyl]-3,4-dihydropyridine
CID 139469841
3-Cyclohex-2-en-1-yl-4,4-dimethyl-6-methylidenequinoline
CID 140979488
3-Methyl-4,4a-dihydroquinoline
CID 141775529
7a,8-Dihydrocyclopropa[i]isoquinoline;ethane
CID 142112818

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1,1a-dihydrocyclopropa[d]quinoline?
The IUPAC name of 2-methyl-1,1a-dihydrocyclopropa[d]quinoline (CID 142233469) is 2-methyl-1,1a-dihydrocyclopropa[d]quinoline.
What is the SMILES notation for 2-methyl-1,1a-dihydrocyclopropa[d]quinoline?
The canonical SMILES for 2-methyl-1,1a-dihydrocyclopropa[d]quinoline is CC1=CN=C2C=CC=CC23CC13.
What is the InChIKey of 2-methyl-1,1a-dihydrocyclopropa[d]quinoline?
The InChIKey is LRFHPBRKVMKBNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N/c1-8-7-12-10-4-2-3-5-11(10)6-9(8)11/h2-5,7,9H,6H2,1H3.
What are the key properties of 2-methyl-1,1a-dihydrocyclopropa[d]quinoline?
2-methyl-1,1a-dihydrocyclopropa[d]quinoline has a molecular weight of 157.22 g/mol, XLogP of 2.48, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1,1a-dihydrocyclopropa[d]quinoline is sourced from PubChem (CID 142233469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).