1-[(1S)-1-(4-aminoimidazo[4,5-c]quinolin-1-yl)propyl]cyclopentan-1-ol

C18H22N4O — CID 150907191

IUPAC1-[(1S)-1-(4-aminoimidazo[4,5-c]quinolin-1-yl)propyl]cyclopentan-1-ol
SMILESCC[C@H](n1cnc2c(N)nc3ccccc3c21)C1(O)CCCC1
InChIInChI=1S/C18H22N4O/c1-2-14(18(23)9-5-6-10-18)22-11-20-15-16(22)12-7-3-4-8-13(12)21-17(15)19/h3-4,7-8,11,14,23H,2,5-6,9-10H2,1H3,(H2,19,21)/t14-/m0/s1
InChIKeyLBFONAIWVFGSAE-AWEZNQCLSA-N
MW310.40 g/mol
LogP3.42
Rot. Bonds3

About 1-[(1S)-1-(4-aminoimidazo[4,5-c]quinolin-1-yl)propyl]cyclopentan-1-ol

1-[(1S)-1-(4-aminoimidazo[4,5-c]quinolin-1-yl)propyl]cyclopentan-1-ol (PubChem CID 150907191) has the molecular formula C18H22N4O and a molecular weight of 310.40 g/mol. Its IUPAC name is 1-[(1S)-1-(4-aminoimidazo[4,5-c]quinolin-1-yl)propyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[(1S)-1-(4-aminoimidazo[4,5-c]quinolin-1-yl)propyl]cyclopentan-1-ol
PubChem CID150907191
Molecular FormulaC18H22N4O
Molecular Weight310.40 g/mol
Exact Mass310.18
IUPAC Name1-[(1S)-1-(4-aminoimidazo[4,5-c]quinolin-1-yl)propyl]cyclopentan-1-ol
SMILESCC[C@H](n1cnc2c(N)nc3ccccc3c21)C1(O)CCCC1
InChIInChI=1S/C18H22N4O/c1-2-14(18(23)9-5-6-10-18)22-11-20-15-16(22)12-7-3-4-8-13(12)21-17(15)19/h3-4,7-8,11,14,23H,2,5-6,9-10H2,1H3,(H2,19,21)/t14-/m0/s1
InChIKeyLBFONAIWVFGSAE-AWEZNQCLSA-N
XLogP3.42
TPSA76.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[(1S)-1-(4-aminoimidazo[4,5-c]quinolin-1-yl)propyl]cyclopentan-1-ol?
The IUPAC name of 1-[(1S)-1-(4-aminoimidazo[4,5-c]quinolin-1-yl)propyl]cyclopentan-1-ol (CID 150907191) is 1-[(1S)-1-(4-aminoimidazo[4,5-c]quinolin-1-yl)propyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[(1S)-1-(4-aminoimidazo[4,5-c]quinolin-1-yl)propyl]cyclopentan-1-ol?
The canonical SMILES for 1-[(1S)-1-(4-aminoimidazo[4,5-c]quinolin-1-yl)propyl]cyclopentan-1-ol is CC[C@H](n1cnc2c(N)nc3ccccc3c21)C1(O)CCCC1.
What is the InChIKey of 1-[(1S)-1-(4-aminoimidazo[4,5-c]quinolin-1-yl)propyl]cyclopentan-1-ol?
The InChIKey is LBFONAIWVFGSAE-AWEZNQCLSA-N. The full InChI is InChI=1S/C18H22N4O/c1-2-14(18(23)9-5-6-10-18)22-11-20-15-16(22)12-7-3-4-8-13(12)21-17(15)19/h3-4,7-8,11,14,23H,2,5-6,9-10H2,1H3,(H2,19,21)/t14-/m0/s1.
What are the key properties of 1-[(1S)-1-(4-aminoimidazo[4,5-c]quinolin-1-yl)propyl]cyclopentan-1-ol?
1-[(1S)-1-(4-aminoimidazo[4,5-c]quinolin-1-yl)propyl]cyclopentan-1-ol has a molecular weight of 310.40 g/mol, XLogP of 3.42, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1S)-1-(4-aminoimidazo[4,5-c]quinolin-1-yl)propyl]cyclopentan-1-ol is sourced from PubChem (CID 150907191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).