3-(4-amino-8-fluoro-7-methyl-3H-imidazo[4,5-c]quinolin-2-yl)propan-1-ol

C14H15FN4O — CID 138607534

IUPAC3-(4-amino-8-fluoro-7-methyl-3H-imidazo[4,5-c]quinolin-2-yl)propan-1-ol
SMILESCc1cc2nc(N)c3[nH]c(CCCO)nc3c2cc1F
InChIInChI=1S/C14H15FN4O/c1-7-5-10-8(6-9(7)15)12-13(14(16)17-10)19-11(18-12)3-2-4-20/h5-6,20H,2-4H2,1H3,(H2,16,17)(H,18,19)
InChIKeyZYEOYPPINJMBHS-UHFFFAOYSA-N
MW274.30 g/mol
LogP2.07
Rot. Bonds3

About 3-(4-amino-8-fluoro-7-methyl-3H-imidazo[4,5-c]quinolin-2-yl)propan-1-ol

3-(4-amino-8-fluoro-7-methyl-3H-imidazo[4,5-c]quinolin-2-yl)propan-1-ol (PubChem CID 138607534) has the molecular formula C14H15FN4O and a molecular weight of 274.30 g/mol. Its IUPAC name is 3-(4-amino-8-fluoro-7-methyl-3H-imidazo[4,5-c]quinolin-2-yl)propan-1-ol.

Molecular Properties

Compound Name3-(4-amino-8-fluoro-7-methyl-3H-imidazo[4,5-c]quinolin-2-yl)propan-1-ol
PubChem CID138607534
Molecular FormulaC14H15FN4O
Molecular Weight274.30 g/mol
Exact Mass274.12
IUPAC Name3-(4-amino-8-fluoro-7-methyl-3H-imidazo[4,5-c]quinolin-2-yl)propan-1-ol
SMILESCc1cc2nc(N)c3[nH]c(CCCO)nc3c2cc1F
InChIInChI=1S/C14H15FN4O/c1-7-5-10-8(6-9(7)15)12-13(14(16)17-10)19-11(18-12)3-2-4-20/h5-6,20H,2-4H2,1H3,(H2,16,17)(H,18,19)
InChIKeyZYEOYPPINJMBHS-UHFFFAOYSA-N
XLogP2.07
TPSA87.82 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 52.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 3-(4-amino-8-fluoro-7-methyl-3H-imidazo[4,5-c]quinolin-2-yl)propan-1-ol with MolForge

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Related Compounds

3-(4-amino-7,8-dichloro-3H-imidazo[4,5-c]quinolin-2-yl)propan-1-ol
CID 138607476
3-[4-amino-7-(trifluoromethyl)-3H-imidazo[4,5-c]quinolin-2-yl]propan-1-ol
CID 138607527
3-[4-amino-7-(3-fluorophenyl)-3H-imidazo[4,5-c]quinolin-2-yl]propan-1-ol
CID 138584372
3-[4-amino-7-(1H-pyrazol-5-yl)-3H-imidazo[4,5-c]quinolin-2-yl]propan-1-ol
CID 138584377
3-[4-amino-2-(3-hydroxypropyl)-3H-imidazo[4,5-c]quinolin-7-yl]phenol
CID 138607621
3-(4-amino-7-cyclohexyl-3H-imidazo[4,5-c]quinolin-2-yl)propan-1-ol
CID 138584388
3-[4-amino-7-(6-methoxy-2-pyridinyl)-3H-imidazo[4,5-c]quinolin-2-yl]propan-1-ol
CID 138607513
2-butyl-7-propan-2-yl-3H-imidazo[4,5-c]quinolin-4-amine
CID 158069633
7-[(4-aminophenyl)methyl]-2-butyl-3H-imidazo[4,5-c]quinolin-4-amine
CID 164926397
3-(4,6-difluoro-1H-benzimidazol-2-yl)propan-1-ol
CID 81463474
3-(2,5-difluoro-4-methylphenyl)propan-1-ol
CID 117280446
3-[5-(4-fluoro-3-methylphenyl)-1H-imidazol-2-yl]propan-1-ol
CID 116878411

Frequently Asked Questions

What is the IUPAC name of 3-(4-amino-8-fluoro-7-methyl-3H-imidazo[4,5-c]quinolin-2-yl)propan-1-ol?
The IUPAC name of 3-(4-amino-8-fluoro-7-methyl-3H-imidazo[4,5-c]quinolin-2-yl)propan-1-ol (CID 138607534) is 3-(4-amino-8-fluoro-7-methyl-3H-imidazo[4,5-c]quinolin-2-yl)propan-1-ol.
What is the SMILES notation for 3-(4-amino-8-fluoro-7-methyl-3H-imidazo[4,5-c]quinolin-2-yl)propan-1-ol?
The canonical SMILES for 3-(4-amino-8-fluoro-7-methyl-3H-imidazo[4,5-c]quinolin-2-yl)propan-1-ol is Cc1cc2nc(N)c3[nH]c(CCCO)nc3c2cc1F.
What is the InChIKey of 3-(4-amino-8-fluoro-7-methyl-3H-imidazo[4,5-c]quinolin-2-yl)propan-1-ol?
The InChIKey is ZYEOYPPINJMBHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN4O/c1-7-5-10-8(6-9(7)15)12-13(14(16)17-10)19-11(18-12)3-2-4-20/h5-6,20H,2-4H2,1H3,(H2,16,17)(H,18,19).
What are the key properties of 3-(4-amino-8-fluoro-7-methyl-3H-imidazo[4,5-c]quinolin-2-yl)propan-1-ol?
3-(4-amino-8-fluoro-7-methyl-3H-imidazo[4,5-c]quinolin-2-yl)propan-1-ol has a molecular weight of 274.30 g/mol, XLogP of 2.07, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-amino-8-fluoro-7-methyl-3H-imidazo[4,5-c]quinolin-2-yl)propan-1-ol is sourced from PubChem (CID 138607534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).