(4-prop-1-en-2-yl-1H-indol-7-yl)methanol

C12H13NO — CID 142488652

IUPAC(4-prop-1-en-2-yl-1H-indol-7-yl)methanol
SMILESC=C(C)c1ccc(CO)c2[nH]ccc12
InChIInChI=1S/C12H13NO/c1-8(2)10-4-3-9(7-14)12-11(10)5-6-13-12/h3-6,13-14H,1,7H2,2H3
InChIKeyCHIHGMKOWDLUMX-UHFFFAOYSA-N
MW187.24 g/mol
LogP2.69
Rot. Bonds2

About (4-prop-1-en-2-yl-1H-indol-7-yl)methanol

(4-prop-1-en-2-yl-1H-indol-7-yl)methanol (PubChem CID 142488652) has the molecular formula C12H13NO and a molecular weight of 187.24 g/mol. Its IUPAC name is (4-prop-1-en-2-yl-1H-indol-7-yl)methanol.

Molecular Properties

Compound Name(4-prop-1-en-2-yl-1H-indol-7-yl)methanol
PubChem CID142488652
Molecular FormulaC12H13NO
Molecular Weight187.24 g/mol
Exact Mass187.10
IUPAC Name(4-prop-1-en-2-yl-1H-indol-7-yl)methanol
SMILESC=C(C)c1ccc(CO)c2[nH]ccc12
InChIInChI=1S/C12H13NO/c1-8(2)10-4-3-9(7-14)12-11(10)5-6-13-12/h3-6,13-14H,1,7H2,2H3
InChIKeyCHIHGMKOWDLUMX-UHFFFAOYSA-N
XLogP2.69
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4-prop-1-en-2-yl-1H-indol-7-yl)methanol?
The IUPAC name of (4-prop-1-en-2-yl-1H-indol-7-yl)methanol (CID 142488652) is (4-prop-1-en-2-yl-1H-indol-7-yl)methanol.
What is the SMILES notation for (4-prop-1-en-2-yl-1H-indol-7-yl)methanol?
The canonical SMILES for (4-prop-1-en-2-yl-1H-indol-7-yl)methanol is C=C(C)c1ccc(CO)c2[nH]ccc12.
What is the InChIKey of (4-prop-1-en-2-yl-1H-indol-7-yl)methanol?
The InChIKey is CHIHGMKOWDLUMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO/c1-8(2)10-4-3-9(7-14)12-11(10)5-6-13-12/h3-6,13-14H,1,7H2,2H3.
What are the key properties of (4-prop-1-en-2-yl-1H-indol-7-yl)methanol?
(4-prop-1-en-2-yl-1H-indol-7-yl)methanol has a molecular weight of 187.24 g/mol, XLogP of 2.69, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-prop-1-en-2-yl-1H-indol-7-yl)methanol is sourced from PubChem (CID 142488652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).