2-methyl-6-propylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]

C15H21N — CID 170254660

IUPAC2-methyl-6-propylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]
SMILESCCCc1ccc2c(c1)C1(CC1)CN(C)C2
InChIInChI=1S/C15H21N/c1-3-4-12-5-6-13-10-16(2)11-15(7-8-15)14(13)9-12/h5-6,9H,3-4,7-8,10-11H2,1-2H3
InChIKeyYHFJFSXHSGHXPV-UHFFFAOYSA-N
MW215.34 g/mol
LogP3.12
Rot. Bonds2

About 2-methyl-6-propylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]

2-methyl-6-propylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane] (PubChem CID 170254660) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is 2-methyl-6-propylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane].

Molecular Properties

Compound Name2-methyl-6-propylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]
PubChem CID170254660
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC Name2-methyl-6-propylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]
SMILESCCCc1ccc2c(c1)C1(CC1)CN(C)C2
InChIInChI=1S/C15H21N/c1-3-4-12-5-6-13-10-16(2)11-15(7-8-15)14(13)9-12/h5-6,9H,3-4,7-8,10-11H2,1-2H3
InChIKeyYHFJFSXHSGHXPV-UHFFFAOYSA-N
XLogP3.12
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-tert-butyl-2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-amine
CID 155362648
2-methyl-7-propan-2-ylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]
CID 156637555
3-propylbicyclo[4.2.0]octa-1(6),2,4-triene
CID 59134563
2-(7-ethylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-2-yl)ethanol
CID 171522905
ethane;7-ethyl-4,4-difluoro-2-methyl-1,3-dihydroisoquinoline
CID 176702040
1-methyl-5-propyl-2,3-dihydroindole
CID 89046240
2-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)ethanol
CID 105445307
1-(7-butyl-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)cyclohexan-1-ol
CID 69003692
2,7-dipropyl-9,10-dihydrophenanthrene
CID 159085021
1-(4-propylphenyl)cyclopropan-1-amine
CID 82280519
N-methyl-6-propylspiro[2H-naphthalene-1,4'-cyclohexane]-1'-amine
CID 149159210
2-methylidene-7-propyl-3,4-dihydro-1H-quinoline
CID 143343070

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-propylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]?
The IUPAC name of 2-methyl-6-propylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane] (CID 170254660) is 2-methyl-6-propylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane].
What is the SMILES notation for 2-methyl-6-propylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]?
The canonical SMILES for 2-methyl-6-propylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane] is CCCc1ccc2c(c1)C1(CC1)CN(C)C2.
What is the InChIKey of 2-methyl-6-propylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]?
The InChIKey is YHFJFSXHSGHXPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c1-3-4-12-5-6-13-10-16(2)11-15(7-8-15)14(13)9-12/h5-6,9H,3-4,7-8,10-11H2,1-2H3.
What are the key properties of 2-methyl-6-propylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]?
2-methyl-6-propylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane] has a molecular weight of 215.34 g/mol, XLogP of 3.12, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-propylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane] is sourced from PubChem (CID 170254660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).