N-[5-chloro-1-(3-methoxypropyl)pyrazol-4-yl]-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine

C18H19ClN6O2 — CID 90104012

IUPACN-[5-chloro-1-(3-methoxypropyl)pyrazol-4-yl]-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine
SMILESCOCCCn1ncc(Nc2nc3cccc(OC)c3c3cn[nH]c23)c1Cl
InChIInChI=1S/C18H19ClN6O2/c1-26-8-4-7-25-17(19)13(10-21-25)23-18-16-11(9-20-24-16)15-12(22-18)5-3-6-14(15)27-2/h3,5-6,9-10H,4,7-8H2,1-2H3,(H,20,24)(H,22,23)
InChIKeyOVDPWYXGABJZED-UHFFFAOYSA-N
MW386.84 g/mol
LogP3.75
Rot. Bonds7

About N-[5-chloro-1-(3-methoxypropyl)pyrazol-4-yl]-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine

N-[5-chloro-1-(3-methoxypropyl)pyrazol-4-yl]-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine (PubChem CID 90104012) has the molecular formula C18H19ClN6O2 and a molecular weight of 386.84 g/mol. Its IUPAC name is N-[5-chloro-1-(3-methoxypropyl)pyrazol-4-yl]-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine.

Molecular Properties

Compound NameN-[5-chloro-1-(3-methoxypropyl)pyrazol-4-yl]-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine
PubChem CID90104012
Molecular FormulaC18H19ClN6O2
Molecular Weight386.84 g/mol
Exact Mass386.13
IUPAC NameN-[5-chloro-1-(3-methoxypropyl)pyrazol-4-yl]-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine
SMILESCOCCCn1ncc(Nc2nc3cccc(OC)c3c3cn[nH]c23)c1Cl
InChIInChI=1S/C18H19ClN6O2/c1-26-8-4-7-25-17(19)13(10-21-25)23-18-16-11(9-20-24-16)15-12(22-18)5-3-6-14(15)27-2/h3,5-6,9-10H,4,7-8H2,1-2H3,(H,20,24)(H,22,23)
InChIKeyOVDPWYXGABJZED-UHFFFAOYSA-N
XLogP3.75
TPSA89.88 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.84
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[5-chloro-1-(3-methoxypropyl)pyrazol-4-yl]-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3,4-Dimethoxyphenyl)-2-(1h-Pyrazol-4-Yl)-1h-Pyrrolo[3,2-C]pyridin-6-Amine
CID 68291131
N-((5-(3-(5-methoxy-1H-benzo[d]imidazol-2-yl)-1H-pyrazolo[3,4-b]pyridin-5-yl)pyridin-3-yl)methyl)ethanamine
CID 135497841
2-[4-[3-chloro-4-(1H-indazol-4-yloxy)anilino]pyrrolo[3,2-d]pyrimidin-5-yl]ethanol
CID 25026281
6-(1H-indazol-4-yl)-N-(3-methoxyphenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 44181707
6-(1H-indazol-6-yl)-N-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine
CID 59473155
1-[5-[3-(6-methoxy-1H-benzimidazol-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]-N-methylmethanamine
CID 135497835
N-[[5-[3-(6-methoxy-1H-benzimidazol-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]methyl]propan-1-amine
CID 135497843
N-[[5-[3-(6-methoxy-1H-benzimidazol-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]methyl]butan-1-amine
CID 135497844
6-methoxy-2-(4-(2-(4-methylpyridin-3-yl)vinyl)-1H-pyrazol-3-yl)-1H-benzo[d]imidazole
CID 135620673
4-(2-(3-(6-methoxy-1H-benzo[d]imidazol-2-yl)-1H-pyrazol-4-yl)vinyl)isoquinoline
CID 135620680
2-[5-[1-(3,5-dichloro-4-pyridinyl)ethoxy]-1H-indazol-3-yl]-6-methoxy-1H-benzimidazole
CID 137133117
4-N-(1H-indazol-5-yl)-2-N-[2-(1H-indol-3-yl)ethyl]-7-methoxyquinazoline-2,4-diamine
CID 137632050

Frequently Asked Questions

What is the IUPAC name of N-[5-chloro-1-(3-methoxypropyl)pyrazol-4-yl]-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine?
The IUPAC name of N-[5-chloro-1-(3-methoxypropyl)pyrazol-4-yl]-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine (CID 90104012) is N-[5-chloro-1-(3-methoxypropyl)pyrazol-4-yl]-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine.
What is the SMILES notation for N-[5-chloro-1-(3-methoxypropyl)pyrazol-4-yl]-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine?
The canonical SMILES for N-[5-chloro-1-(3-methoxypropyl)pyrazol-4-yl]-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine is COCCCn1ncc(Nc2nc3cccc(OC)c3c3cn[nH]c23)c1Cl.
What is the InChIKey of N-[5-chloro-1-(3-methoxypropyl)pyrazol-4-yl]-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine?
The InChIKey is OVDPWYXGABJZED-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN6O2/c1-26-8-4-7-25-17(19)13(10-21-25)23-18-16-11(9-20-24-16)15-12(22-18)5-3-6-14(15)27-2/h3,5-6,9-10H,4,7-8H2,1-2H3,(H,20,24)(H,22,23).
What are the key properties of N-[5-chloro-1-(3-methoxypropyl)pyrazol-4-yl]-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine?
N-[5-chloro-1-(3-methoxypropyl)pyrazol-4-yl]-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine has a molecular weight of 386.84 g/mol, XLogP of 3.75, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-chloro-1-(3-methoxypropyl)pyrazol-4-yl]-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine is sourced from PubChem (CID 90104012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).