2-(3-amino-1H-pyrazol-5-yl)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol

C14H17N3O2 — CID 136963394

IUPAC2-(3-amino-1H-pyrazol-5-yl)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol
SMILESCOc1cc(-c2cc(N)n[nH]2)c(O)c2c1CCCC2
InChIInChI=1S/C14H17N3O2/c1-19-12-6-10(11-7-13(15)17-16-11)14(18)9-5-3-2-4-8(9)12/h6-7,18H,2-5H2,1H3,(H3,15,16,17)
InChIKeyBUJLCNWLTFVXQR-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.25
Rot. Bonds2

About 2-(3-amino-1H-pyrazol-5-yl)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol

2-(3-amino-1H-pyrazol-5-yl)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol (PubChem CID 136963394) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-(3-amino-1H-pyrazol-5-yl)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name2-(3-amino-1H-pyrazol-5-yl)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol
PubChem CID136963394
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name2-(3-amino-1H-pyrazol-5-yl)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol
SMILESCOc1cc(-c2cc(N)n[nH]2)c(O)c2c1CCCC2
InChIInChI=1S/C14H17N3O2/c1-19-12-6-10(11-7-13(15)17-16-11)14(18)9-5-3-2-4-8(9)12/h6-7,18H,2-5H2,1H3,(H3,15,16,17)
InChIKeyBUJLCNWLTFVXQR-UHFFFAOYSA-N
XLogP2.25
TPSA84.16 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-(3-amino-1H-pyrazol-5-yl)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol 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

2-(5-amino-1,2-oxazol-3-yl)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol
CID 136963436
2-(3-amino-1H-pyrazol-5-yl)-4-methoxy-5-methylphenol
CID 136993747
4-(3-amino-1H-pyrazol-5-yl)-2,5-dimethoxyphenol
CID 137017080
5-(2-fluoro-5-methoxy-4-methylphenyl)-1H-pyrazol-3-amine
CID 117315411
2-(3-amino-1H-pyrazol-5-yl)-3-methoxy-6-methylphenol
CID 136993746
5-[4,5-dimethoxy-2-(methoxymethyl)phenyl]-1H-pyrazol-3-amine
CID 117412508
5-(7-chloro-6-methoxy-2,3-dihydro-1H-inden-5-yl)-1H-pyrazol-3-amine
CID 117414124
5-(2-bromo-3-methoxy-6-methylphenyl)-1H-pyrazol-3-amine
CID 117453081
2-(1-aminoethyl)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol
CID 117316674
5-(6-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-1H-pyrazol-3-amine
CID 117369983
methyl 5-(3-amino-1H-pyrazol-5-yl)-4-hydroxy-2-methoxybenzoate
CID 137004785
5-(3-amino-1H-pyrazol-5-yl)-2-methoxyphenol
CID 130019057

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-1H-pyrazol-5-yl)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol?
The IUPAC name of 2-(3-amino-1H-pyrazol-5-yl)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol (CID 136963394) is 2-(3-amino-1H-pyrazol-5-yl)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol.
What is the SMILES notation for 2-(3-amino-1H-pyrazol-5-yl)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol?
The canonical SMILES for 2-(3-amino-1H-pyrazol-5-yl)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol is COc1cc(-c2cc(N)n[nH]2)c(O)c2c1CCCC2.
What is the InChIKey of 2-(3-amino-1H-pyrazol-5-yl)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol?
The InChIKey is BUJLCNWLTFVXQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-19-12-6-10(11-7-13(15)17-16-11)14(18)9-5-3-2-4-8(9)12/h6-7,18H,2-5H2,1H3,(H3,15,16,17).
What are the key properties of 2-(3-amino-1H-pyrazol-5-yl)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol?
2-(3-amino-1H-pyrazol-5-yl)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol has a molecular weight of 259.31 g/mol, XLogP of 2.25, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-1H-pyrazol-5-yl)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 136963394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).