5-methyl-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane]

C17H26N2 — CID 115097965

IUPAC5-methyl-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane]
SMILESCc1cccc2c1N(C(C)C)C1(CCCCC1)CN2
InChIInChI=1S/C17H26N2/c1-13(2)19-16-14(3)8-7-9-15(16)18-12-17(19)10-5-4-6-11-17/h7-9,13,18H,4-6,10-12H2,1-3H3
InChIKeyQOLCELZXZGJIEF-UHFFFAOYSA-N
MW258.41 g/mol
LogP4.34
Rot. Bonds1

About 5-methyl-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane]

5-methyl-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane] (PubChem CID 115097965) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 5-methyl-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane].

Molecular Properties

Compound Name5-methyl-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane]
PubChem CID115097965
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC Name5-methyl-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane]
SMILESCc1cccc2c1N(C(C)C)C1(CCCCC1)CN2
InChIInChI=1S/C17H26N2/c1-13(2)19-16-14(3)8-7-9-15(16)18-12-17(19)10-5-4-6-11-17/h7-9,13,18H,4-6,10-12H2,1-3H3
InChIKeyQOLCELZXZGJIEF-UHFFFAOYSA-N
XLogP4.34
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-methyl-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane] with MolForge

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Related Compounds

5-fluoro-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane]
CID 115097649
5,6-dimethylspiro[2,4-dihydro-1H-1,5-benzodiazepine-3,1'-cyclopentane]
CID 115099504
5-bromo-4-methylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane]
CID 115097943
5-methyl-4-propan-2-ylspiro[1H-quinoxaline-3,1'-cyclobutane]-2-one
CID 115097275
5-methoxy-4-methylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane]
CID 115097947
4-methyl-5-(trifluoromethyl)spiro[1,2-dihydroquinoxaline-3,1'-cyclohexane]
CID 115097937
8-methoxy-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane]
CID 115098056
5-tert-butyl-4-methylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane]
CID 84637531
7-fluoro-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane]
CID 115097804
5-methoxy-4-methylspiro[1,2-dihydroquinoxaline-3,1'-cyclobutane]
CID 115097269
3,5-dimethyl-4-propan-2-yl-2,3-dihydro-1H-quinoxaline
CID 115095460
6-methylspiro[4,5-dihydro-1H-1,5-benzodiazepine-3,1'-cyclohexane]-2-one
CID 115554290

Frequently Asked Questions

What is the IUPAC name of 5-methyl-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane]?
The IUPAC name of 5-methyl-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane] (CID 115097965) is 5-methyl-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane].
What is the SMILES notation for 5-methyl-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane]?
The canonical SMILES for 5-methyl-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane] is Cc1cccc2c1N(C(C)C)C1(CCCCC1)CN2.
What is the InChIKey of 5-methyl-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane]?
The InChIKey is QOLCELZXZGJIEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-13(2)19-16-14(3)8-7-9-15(16)18-12-17(19)10-5-4-6-11-17/h7-9,13,18H,4-6,10-12H2,1-3H3.
What are the key properties of 5-methyl-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane]?
5-methyl-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane] has a molecular weight of 258.41 g/mol, XLogP of 4.34, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane] is sourced from PubChem (CID 115097965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).