[4-(4-amino-3H-imidazo[4,5-c]quinolin-7-yl)phenyl]methanol

C17H14N4O — CID 175755127

IUPAC[4-(4-amino-3H-imidazo[4,5-c]quinolin-7-yl)phenyl]methanol
SMILESNc1nc2cc(-c3ccc(CO)cc3)ccc2c2nc[nH]c12
InChIInChI=1S/C17H14N4O/c18-17-16-15(19-9-20-16)13-6-5-12(7-14(13)21-17)11-3-1-10(8-22)2-4-11/h1-7,9,22H,8H2,(H2,18,21)(H,19,20)
InChIKeyZSNBBNIBESIUMQ-UHFFFAOYSA-N
MW290.33 g/mol
LogP2.85
Rot. Bonds2

About [4-(4-amino-3H-imidazo[4,5-c]quinolin-7-yl)phenyl]methanol

[4-(4-amino-3H-imidazo[4,5-c]quinolin-7-yl)phenyl]methanol (PubChem CID 175755127) has the molecular formula C17H14N4O and a molecular weight of 290.33 g/mol. Its IUPAC name is [4-(4-amino-3H-imidazo[4,5-c]quinolin-7-yl)phenyl]methanol.

Molecular Properties

Compound Name[4-(4-amino-3H-imidazo[4,5-c]quinolin-7-yl)phenyl]methanol
PubChem CID175755127
Molecular FormulaC17H14N4O
Molecular Weight290.33 g/mol
Exact Mass290.12
IUPAC Name[4-(4-amino-3H-imidazo[4,5-c]quinolin-7-yl)phenyl]methanol
SMILESNc1nc2cc(-c3ccc(CO)cc3)ccc2c2nc[nH]c12
InChIInChI=1S/C17H14N4O/c18-17-16-15(19-9-20-16)13-6-5-12(7-14(13)21-17)11-3-1-10(8-22)2-4-11/h1-7,9,22H,8H2,(H2,18,21)(H,19,20)
InChIKeyZSNBBNIBESIUMQ-UHFFFAOYSA-N
XLogP2.85
TPSA87.82 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.33
LogP ≤ 52.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [4-(4-amino-3H-imidazo[4,5-c]quinolin-7-yl)phenyl]methanol?
The IUPAC name of [4-(4-amino-3H-imidazo[4,5-c]quinolin-7-yl)phenyl]methanol (CID 175755127) is [4-(4-amino-3H-imidazo[4,5-c]quinolin-7-yl)phenyl]methanol.
What is the SMILES notation for [4-(4-amino-3H-imidazo[4,5-c]quinolin-7-yl)phenyl]methanol?
The canonical SMILES for [4-(4-amino-3H-imidazo[4,5-c]quinolin-7-yl)phenyl]methanol is Nc1nc2cc(-c3ccc(CO)cc3)ccc2c2nc[nH]c12.
What is the InChIKey of [4-(4-amino-3H-imidazo[4,5-c]quinolin-7-yl)phenyl]methanol?
The InChIKey is ZSNBBNIBESIUMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O/c18-17-16-15(19-9-20-16)13-6-5-12(7-14(13)21-17)11-3-1-10(8-22)2-4-11/h1-7,9,22H,8H2,(H2,18,21)(H,19,20).
What are the key properties of [4-(4-amino-3H-imidazo[4,5-c]quinolin-7-yl)phenyl]methanol?
[4-(4-amino-3H-imidazo[4,5-c]quinolin-7-yl)phenyl]methanol has a molecular weight of 290.33 g/mol, XLogP of 2.85, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-amino-3H-imidazo[4,5-c]quinolin-7-yl)phenyl]methanol is sourced from PubChem (CID 175755127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).