(7-ethyl-1H-indol-3-yl)-(1H-indol-3-yl)methanol

C19H18N2O — CID 53315772

IUPAC(7-ethyl-1H-indol-3-yl)-(1H-indol-3-yl)methanol
SMILESCCc1cccc2c(C(O)c3c[nH]c4ccccc34)c[nH]c12
InChIInChI=1S/C19H18N2O/c1-2-12-6-5-8-14-16(11-21-18(12)14)19(22)15-10-20-17-9-4-3-7-13(15)17/h3-11,19-22H,2H2,1H3
InChIKeyHJXALSAIDJFHGT-UHFFFAOYSA-N
MW290.37 g/mol
LogP4.29
Rot. Bonds3

About (7-ethyl-1H-indol-3-yl)-(1H-indol-3-yl)methanol

(7-ethyl-1H-indol-3-yl)-(1H-indol-3-yl)methanol (PubChem CID 53315772) has the molecular formula C19H18N2O and a molecular weight of 290.37 g/mol. Its IUPAC name is (7-ethyl-1H-indol-3-yl)-(1H-indol-3-yl)methanol.

Molecular Properties

Compound Name(7-ethyl-1H-indol-3-yl)-(1H-indol-3-yl)methanol
PubChem CID53315772
Molecular FormulaC19H18N2O
Molecular Weight290.37 g/mol
Exact Mass290.14
IUPAC Name(7-ethyl-1H-indol-3-yl)-(1H-indol-3-yl)methanol
SMILESCCc1cccc2c(C(O)c3c[nH]c4ccccc34)c[nH]c12
InChIInChI=1S/C19H18N2O/c1-2-12-6-5-8-14-16(11-21-18(12)14)19(22)15-10-20-17-9-4-3-7-13(15)17/h3-11,19-22H,2H2,1H3
InChIKeyHJXALSAIDJFHGT-UHFFFAOYSA-N
XLogP4.29
TPSA51.81 Ų
H-Bond Donors3
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 54.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (7-ethyl-1H-indol-3-yl)-(1H-indol-3-yl)methanol?
The IUPAC name of (7-ethyl-1H-indol-3-yl)-(1H-indol-3-yl)methanol (CID 53315772) is (7-ethyl-1H-indol-3-yl)-(1H-indol-3-yl)methanol.
What is the SMILES notation for (7-ethyl-1H-indol-3-yl)-(1H-indol-3-yl)methanol?
The canonical SMILES for (7-ethyl-1H-indol-3-yl)-(1H-indol-3-yl)methanol is CCc1cccc2c(C(O)c3c[nH]c4ccccc34)c[nH]c12.
What is the InChIKey of (7-ethyl-1H-indol-3-yl)-(1H-indol-3-yl)methanol?
The InChIKey is HJXALSAIDJFHGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O/c1-2-12-6-5-8-14-16(11-21-18(12)14)19(22)15-10-20-17-9-4-3-7-13(15)17/h3-11,19-22H,2H2,1H3.
What are the key properties of (7-ethyl-1H-indol-3-yl)-(1H-indol-3-yl)methanol?
(7-ethyl-1H-indol-3-yl)-(1H-indol-3-yl)methanol has a molecular weight of 290.37 g/mol, XLogP of 4.29, 3 rotatable bonds, 3 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (7-ethyl-1H-indol-3-yl)-(1H-indol-3-yl)methanol is sourced from PubChem (CID 53315772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).