2-(2,3-dihydro-1H-indol-6-yl)-5-[1-[(dimethylamino)methyl]cyclopropyl]phenol

C20H24N2O — CID 91219962

IUPAC2-(2,3-dihydro-1H-indol-6-yl)-5-[1-[(dimethylamino)methyl]cyclopropyl]phenol
SMILESCN(C)CC1(c2ccc(-c3ccc4c(c3)NCC4)c(O)c2)CC1
InChIInChI=1S/C20H24N2O/c1-22(2)13-20(8-9-20)16-5-6-17(19(23)12-16)15-4-3-14-7-10-21-18(14)11-15/h3-6,11-12,21,23H,7-10,13H2,1-2H3
InChIKeySGCHYTCWLRSDRT-UHFFFAOYSA-N
MW308.43 g/mol
LogP3.62
Rot. Bonds4

About 2-(2,3-dihydro-1H-indol-6-yl)-5-[1-[(dimethylamino)methyl]cyclopropyl]phenol

2-(2,3-dihydro-1H-indol-6-yl)-5-[1-[(dimethylamino)methyl]cyclopropyl]phenol (PubChem CID 91219962) has the molecular formula C20H24N2O and a molecular weight of 308.43 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-indol-6-yl)-5-[1-[(dimethylamino)methyl]cyclopropyl]phenol.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-indol-6-yl)-5-[1-[(dimethylamino)methyl]cyclopropyl]phenol
PubChem CID91219962
Molecular FormulaC20H24N2O
Molecular Weight308.43 g/mol
Exact Mass308.19
IUPAC Name2-(2,3-dihydro-1H-indol-6-yl)-5-[1-[(dimethylamino)methyl]cyclopropyl]phenol
SMILESCN(C)CC1(c2ccc(-c3ccc4c(c3)NCC4)c(O)c2)CC1
InChIInChI=1S/C20H24N2O/c1-22(2)13-20(8-9-20)16-5-6-17(19(23)12-16)15-4-3-14-7-10-21-18(14)11-15/h3-6,11-12,21,23H,7-10,13H2,1-2H3
InChIKeySGCHYTCWLRSDRT-UHFFFAOYSA-N
XLogP3.62
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-(4-fluoronaphthalen-1-yl)-2,3-dihydro-1H-indole
CID 116698579
6-(3,4-diethylphenyl)-2,3-dihydro-1H-indole
CID 116698615
2-(2,3-dihydro-1H-indol-6-yl)-N,N-dimethylethanamine
CID 115105305
6-(5-fluoro-2-methylphenyl)-2,3-dihydro-1H-indole
CID 116698427
7-(2,4-dimethoxyphenyl)-1,2,3,4-tetrahydroquinoline
CID 81224636
1-[[2,3-dihydro-1H-indol-6-ylmethyl(methyl)amino]methyl]-N,N-dimethylcyclobutan-1-amine
CID 105421360
6-(2,5-difluorophenyl)-2,3-dihydro-1H-indole
CID 116698446
6-(3-ethyl-1-methylpyrazol-4-yl)-2,3-dihydro-1H-indole
CID 116698590
6-(2,3-dimethoxyphenyl)-2,3-dihydro-1H-indole
CID 116698516
6-(1,3-dimethylpyrazol-4-yl)-2,3-dihydro-1H-indole
CID 116698588
6-(3,3-dimethyl-2H-1-benzofuran-5-yl)-2,3-dihydro-1H-indole
CID 107293887
1-[1-(4-bromophenyl)cyclopropyl]-N,N-dimethylmethanamine
CID 68890451

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-indol-6-yl)-5-[1-[(dimethylamino)methyl]cyclopropyl]phenol?
The IUPAC name of 2-(2,3-dihydro-1H-indol-6-yl)-5-[1-[(dimethylamino)methyl]cyclopropyl]phenol (CID 91219962) is 2-(2,3-dihydro-1H-indol-6-yl)-5-[1-[(dimethylamino)methyl]cyclopropyl]phenol.
What is the SMILES notation for 2-(2,3-dihydro-1H-indol-6-yl)-5-[1-[(dimethylamino)methyl]cyclopropyl]phenol?
The canonical SMILES for 2-(2,3-dihydro-1H-indol-6-yl)-5-[1-[(dimethylamino)methyl]cyclopropyl]phenol is CN(C)CC1(c2ccc(-c3ccc4c(c3)NCC4)c(O)c2)CC1.
What is the InChIKey of 2-(2,3-dihydro-1H-indol-6-yl)-5-[1-[(dimethylamino)methyl]cyclopropyl]phenol?
The InChIKey is SGCHYTCWLRSDRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O/c1-22(2)13-20(8-9-20)16-5-6-17(19(23)12-16)15-4-3-14-7-10-21-18(14)11-15/h3-6,11-12,21,23H,7-10,13H2,1-2H3.
What are the key properties of 2-(2,3-dihydro-1H-indol-6-yl)-5-[1-[(dimethylamino)methyl]cyclopropyl]phenol?
2-(2,3-dihydro-1H-indol-6-yl)-5-[1-[(dimethylamino)methyl]cyclopropyl]phenol has a molecular weight of 308.43 g/mol, XLogP of 3.62, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-indol-6-yl)-5-[1-[(dimethylamino)methyl]cyclopropyl]phenol is sourced from PubChem (CID 91219962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).