4-amino-2-butyl-1-(2-methylpropyl)imidazo[4,5-c]quinolin-7-ol

C18H24N4O — CID 155213914

IUPAC4-amino-2-butyl-1-(2-methylpropyl)imidazo[4,5-c]quinolin-7-ol
SMILESCCCCc1nc2c(N)nc3cc(O)ccc3c2n1CC(C)C
InChIInChI=1S/C18H24N4O/c1-4-5-6-15-21-16-17(22(15)10-11(2)3)13-8-7-12(23)9-14(13)20-18(16)19/h7-9,11,23H,4-6,10H2,1-3H3,(H2,19,20)
InChIKeyPYPCPBDCDWVNSI-UHFFFAOYSA-N
MW312.42 g/mol
LogP3.87
Rot. Bonds5

About 4-amino-2-butyl-1-(2-methylpropyl)imidazo[4,5-c]quinolin-7-ol

4-amino-2-butyl-1-(2-methylpropyl)imidazo[4,5-c]quinolin-7-ol (PubChem CID 155213914) has the molecular formula C18H24N4O and a molecular weight of 312.42 g/mol. Its IUPAC name is 4-amino-2-butyl-1-(2-methylpropyl)imidazo[4,5-c]quinolin-7-ol.

Molecular Properties

Compound Name4-amino-2-butyl-1-(2-methylpropyl)imidazo[4,5-c]quinolin-7-ol
PubChem CID155213914
Molecular FormulaC18H24N4O
Molecular Weight312.42 g/mol
Exact Mass312.20
IUPAC Name4-amino-2-butyl-1-(2-methylpropyl)imidazo[4,5-c]quinolin-7-ol
SMILESCCCCc1nc2c(N)nc3cc(O)ccc3c2n1CC(C)C
InChIInChI=1S/C18H24N4O/c1-4-5-6-15-21-16-17(22(15)10-11(2)3)13-8-7-12(23)9-14(13)20-18(16)19/h7-9,11,23H,4-6,10H2,1-3H3,(H2,19,20)
InChIKeyPYPCPBDCDWVNSI-UHFFFAOYSA-N
XLogP3.87
TPSA76.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.42
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

RP107
CID 448912
(1M)-2-amino-1-(5-hydroxy-2-methylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
CID 91933866
4-{5H-pyrrolo[2,3-b]pyrazin-6-yl}phenol
CID 135433406
6-phenyl[5H]pyrrolo[2,3-b]pyrazine (aloisine) 28
CID 135434952
4-{2-amino-1-methyl-1H-imidazo[4,5-b]pyridin-6-yl}phenol
CID 15897928
3-{[2-(1H-Benzimidazol-1-YL)-6-{[2-(diethylamino)ethyl]amino}pyrimidin-4-YL]amino}-4-methylphenol
CID 9547983
6-phenyl[5H]pyrrolo[2,3-b]pyrazine (aloisine) 33
CID 135434953
4-(7-Methyl-2,4-dipyrrolidin-1-ylpyrrolo[2,3-d]pyrimidin-6-yl)phenol
CID 10690093
3-(8-Amino-3-cyclobutylimidazo[1,5-a]pyrazin-1-yl)phenol
CID 11716093
3-(1-(6-amino-2-methylpyrimidin-4-yl)-1H-benzo[d]imidazol-2-ylamino)phenol
CID 46893618
(S)-2-(4-(1-methylpyrrolidin-3-ylamino)quinazolin-2-yl)phenol
CID 135921309
(S)-2-(4-(Methyl(pyrrolidin-3-yl)amino)quinazolin-2-yl)phenol
CID 135921415

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-butyl-1-(2-methylpropyl)imidazo[4,5-c]quinolin-7-ol?
The IUPAC name of 4-amino-2-butyl-1-(2-methylpropyl)imidazo[4,5-c]quinolin-7-ol (CID 155213914) is 4-amino-2-butyl-1-(2-methylpropyl)imidazo[4,5-c]quinolin-7-ol.
What is the SMILES notation for 4-amino-2-butyl-1-(2-methylpropyl)imidazo[4,5-c]quinolin-7-ol?
The canonical SMILES for 4-amino-2-butyl-1-(2-methylpropyl)imidazo[4,5-c]quinolin-7-ol is CCCCc1nc2c(N)nc3cc(O)ccc3c2n1CC(C)C.
What is the InChIKey of 4-amino-2-butyl-1-(2-methylpropyl)imidazo[4,5-c]quinolin-7-ol?
The InChIKey is PYPCPBDCDWVNSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O/c1-4-5-6-15-21-16-17(22(15)10-11(2)3)13-8-7-12(23)9-14(13)20-18(16)19/h7-9,11,23H,4-6,10H2,1-3H3,(H2,19,20).
What are the key properties of 4-amino-2-butyl-1-(2-methylpropyl)imidazo[4,5-c]quinolin-7-ol?
4-amino-2-butyl-1-(2-methylpropyl)imidazo[4,5-c]quinolin-7-ol has a molecular weight of 312.42 g/mol, XLogP of 3.87, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-butyl-1-(2-methylpropyl)imidazo[4,5-c]quinolin-7-ol is sourced from PubChem (CID 155213914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).