1H-indol-4-ol

C8H7NO — CID 102220556

IUPAC1H-indol-4-ol
SMILESOc1cccc2[15nH]ccc12
InChIInChI=1S/C8H7NO/c10-8-3-1-2-7-6(8)4-5-9-7/h1-5,9-10H/i9+1
InChIKeyNLMQHXUGJIAKTH-QBZHADDCSA-N
MW134.14 g/mol
LogP1.87
Rot. Bonds

About 1H-indol-4-ol

1H-indol-4-ol (PubChem CID 102220556) has the molecular formula C8H7NO and a molecular weight of 134.14 g/mol. Its IUPAC name is 1H-indol-4-ol.

Molecular Properties

Compound Name1H-indol-4-ol
PubChem CID102220556
Molecular FormulaC8H7NO
Molecular Weight134.14 g/mol
Exact Mass134.05
IUPAC Name1H-indol-4-ol
SMILESOc1cccc2[15nH]ccc12
InChIInChI=1S/C8H7NO/c10-8-3-1-2-7-6(8)4-5-9-7/h1-5,9-10H/i9+1
InChIKeyNLMQHXUGJIAKTH-QBZHADDCSA-N
XLogP1.87
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.14
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1H-indol-4-amine;hydrochloride
CID 22461572
4-(iodomethyl)-1H-indole
CID 143791617
4-(3-methylbut-3-enyl)-1H-indole
CID 14010474
4-(2-methylbut-2-enyl)-1H-indole
CID 141009102
CID 58110672
CID 58110672
ethane;1H-indol-4-ylmethanamine
CID 144540106
1H-indole-4-carbonyl bromide
CID 175285982
1H-indole-4-carboxylate
CID 6951562
2-chloro-3-[(1H-indol-4-ylmethylamino)methyl]phenol
CID 167760392
N-[2-(1H-indol-4-yl)ethylidene]hydroxylamine
CID 131861438
4-(isocyanomethyl)-1H-indole
CID 83479881
O-(1H-indol-4-ylmethyl)hydroxylamine
CID 117276139

Frequently Asked Questions

What is the IUPAC name of 1H-indol-4-ol?
The IUPAC name of 1H-indol-4-ol (CID 102220556) is 1H-indol-4-ol.
What is the SMILES notation for 1H-indol-4-ol?
The canonical SMILES for 1H-indol-4-ol is Oc1cccc2[15nH]ccc12.
What is the InChIKey of 1H-indol-4-ol?
The InChIKey is NLMQHXUGJIAKTH-QBZHADDCSA-N. The full InChI is InChI=1S/C8H7NO/c10-8-3-1-2-7-6(8)4-5-9-7/h1-5,9-10H/i9+1.
What are the key properties of 1H-indol-4-ol?
1H-indol-4-ol has a molecular weight of 134.14 g/mol, XLogP of 1.87, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-indol-4-ol is sourced from PubChem (CID 102220556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).