1-(3-bromo-1H-indol-6-yl)cyclopropan-1-ol

C11H10BrNO — CID 117383077

IUPAC1-(3-bromo-1H-indol-6-yl)cyclopropan-1-ol
SMILESOC1(c2ccc3c(Br)c[nH]c3c2)CC1
InChIInChI=1S/C11H10BrNO/c12-9-6-13-10-5-7(1-2-8(9)10)11(14)3-4-11/h1-2,5-6,13-14H,3-4H2
InChIKeyCIERTTOHAJEPHF-UHFFFAOYSA-N
MW252.11 g/mol
LogP2.91
Rot. Bonds1

About 1-(3-bromo-1H-indol-6-yl)cyclopropan-1-ol

1-(3-bromo-1H-indol-6-yl)cyclopropan-1-ol (PubChem CID 117383077) has the molecular formula C11H10BrNO and a molecular weight of 252.11 g/mol. Its IUPAC name is 1-(3-bromo-1H-indol-6-yl)cyclopropan-1-ol.

Molecular Properties

Compound Name1-(3-bromo-1H-indol-6-yl)cyclopropan-1-ol
PubChem CID117383077
Molecular FormulaC11H10BrNO
Molecular Weight252.11 g/mol
Exact Mass250.99
IUPAC Name1-(3-bromo-1H-indol-6-yl)cyclopropan-1-ol
SMILESOC1(c2ccc3c(Br)c[nH]c3c2)CC1
InChIInChI=1S/C11H10BrNO/c12-9-6-13-10-5-7(1-2-8(9)10)11(14)3-4-11/h1-2,5-6,13-14H,3-4H2
InChIKeyCIERTTOHAJEPHF-UHFFFAOYSA-N
XLogP2.91
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.11
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

[1-(3-bromo-1H-indol-6-yl)cyclopropyl]methanamine
CID 117416499
1-[(3-bromo-1H-indol-6-yl)methyl]cyclopropan-1-ol
CID 117419095
2-bromo-5-(1-hydroxycyclopropyl)phenol
CID 84792504
1-[(3-bromo-1H-indol-6-yl)sulfonyl]-3-methylpyrrolidin-3-ol
CID 145444330
3-bromo-6-cyclopropyl-1H-indole
CID 130052143
1-(3-bromo-1H-indol-6-yl)ethanone
CID 83897897
3-bromo-1H-indole-6-carbaldehyde
CID 74787786
1-[3-bromo-4-(dimethylamino)phenyl]cyclopropan-1-ol
CID 117393248
1-(3-bromo-1-methylindol-5-yl)cyclopropan-1-ol
CID 117419101
3-bromo-6-nitro-1H-indole
CID 14707934
1-(3-bromo-4-pentan-3-ylphenyl)cyclopropan-1-ol
CID 117455081
1,4-bis(4-fluorophenyl)cyclohexane-1,4-diol
CID 10709619

Frequently Asked Questions

What is the IUPAC name of 1-(3-bromo-1H-indol-6-yl)cyclopropan-1-ol?
The IUPAC name of 1-(3-bromo-1H-indol-6-yl)cyclopropan-1-ol (CID 117383077) is 1-(3-bromo-1H-indol-6-yl)cyclopropan-1-ol.
What is the SMILES notation for 1-(3-bromo-1H-indol-6-yl)cyclopropan-1-ol?
The canonical SMILES for 1-(3-bromo-1H-indol-6-yl)cyclopropan-1-ol is OC1(c2ccc3c(Br)c[nH]c3c2)CC1.
What is the InChIKey of 1-(3-bromo-1H-indol-6-yl)cyclopropan-1-ol?
The InChIKey is CIERTTOHAJEPHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10BrNO/c12-9-6-13-10-5-7(1-2-8(9)10)11(14)3-4-11/h1-2,5-6,13-14H,3-4H2.
What are the key properties of 1-(3-bromo-1H-indol-6-yl)cyclopropan-1-ol?
1-(3-bromo-1H-indol-6-yl)cyclopropan-1-ol has a molecular weight of 252.11 g/mol, XLogP of 2.91, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-bromo-1H-indol-6-yl)cyclopropan-1-ol is sourced from PubChem (CID 117383077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).