4,10b-dimethyl-1,2,3,4a,5,6-hexahydrobenzo[f]quinoline

C15H21N — CID 15555065

IUPAC4,10b-dimethyl-1,2,3,4a,5,6-hexahydrobenzo[f]quinoline
SMILESCN1CCCC2(C)c3ccccc3CCC12
InChIInChI=1S/C15H21N/c1-15-10-5-11-16(2)14(15)9-8-12-6-3-4-7-13(12)15/h3-4,6-7,14H,5,8-11H2,1-2H3
InChIKeyDMAVPELBUCMLHN-UHFFFAOYSA-N
MW215.34 g/mol
LogP2.98
Rot. Bonds

About 4,10b-dimethyl-1,2,3,4a,5,6-hexahydrobenzo[f]quinoline

4,10b-dimethyl-1,2,3,4a,5,6-hexahydrobenzo[f]quinoline (PubChem CID 15555065) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is 4,10b-dimethyl-1,2,3,4a,5,6-hexahydrobenzo[f]quinoline.

Molecular Properties

Compound Name4,10b-dimethyl-1,2,3,4a,5,6-hexahydrobenzo[f]quinoline
PubChem CID15555065
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC Name4,10b-dimethyl-1,2,3,4a,5,6-hexahydrobenzo[f]quinoline
SMILESCN1CCCC2(C)c3ccccc3CCC12
InChIInChI=1S/C15H21N/c1-15-10-5-11-16(2)14(15)9-8-12-6-3-4-7-13(12)15/h3-4,6-7,14H,5,8-11H2,1-2H3
InChIKeyDMAVPELBUCMLHN-UHFFFAOYSA-N
XLogP2.98
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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(1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl)methanamine
CID 3733027
5,10b-dimethyl-2,4,4a,6-tetrahydro-1H-phenanthridin-3-one
CID 19960946
1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carbonyl chloride
CID 144508012
(1S,4aS,10aR)-4a-methyl-1-(trifluoromethyl)-2,3,4,9,10,10a-hexahydrophenanthren-1-ol
CID 11822169
2-(1-methyl-2,3-dihydroinden-1-yl)pyrrolidine
CID 122502681
(1R,9S,13S)-1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene;hydrobromide
CID 3048328
1,1,4a-trimethyl-4,9,10,10a-tetrahydrophenanthrene
CID 123682329
1'-(cyclohexylmethyl)-2-methylspiro[3,4-dihydroisoquinoline-1,4'-piperidine]
CID 121359802
N,N-dimethyl-2,3,4,9,10,10a-hexahydro-1H-phenanthren-4a-amine
CID 15657719
5-methyl-6,7,8,9-tetrahydrobenzo[7]annulen-5-ol
CID 15751789
2-piperidin-1-yl-1-propyl-3,4-dihydro-2H-naphthalen-1-amine
CID 43830913

Frequently Asked Questions

What is the IUPAC name of 4,10b-dimethyl-1,2,3,4a,5,6-hexahydrobenzo[f]quinoline?
The IUPAC name of 4,10b-dimethyl-1,2,3,4a,5,6-hexahydrobenzo[f]quinoline (CID 15555065) is 4,10b-dimethyl-1,2,3,4a,5,6-hexahydrobenzo[f]quinoline.
What is the SMILES notation for 4,10b-dimethyl-1,2,3,4a,5,6-hexahydrobenzo[f]quinoline?
The canonical SMILES for 4,10b-dimethyl-1,2,3,4a,5,6-hexahydrobenzo[f]quinoline is CN1CCCC2(C)c3ccccc3CCC12.
What is the InChIKey of 4,10b-dimethyl-1,2,3,4a,5,6-hexahydrobenzo[f]quinoline?
The InChIKey is DMAVPELBUCMLHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c1-15-10-5-11-16(2)14(15)9-8-12-6-3-4-7-13(12)15/h3-4,6-7,14H,5,8-11H2,1-2H3.
What are the key properties of 4,10b-dimethyl-1,2,3,4a,5,6-hexahydrobenzo[f]quinoline?
4,10b-dimethyl-1,2,3,4a,5,6-hexahydrobenzo[f]quinoline has a molecular weight of 215.34 g/mol, XLogP of 2.98, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,10b-dimethyl-1,2,3,4a,5,6-hexahydrobenzo[f]quinoline is sourced from PubChem (CID 15555065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).