5-methoxy-N-phenyl-1,4-dihydroindeno[2,1-d]pyrazol-3-amine

C17H15N3O — CID 11536421

IUPAC5-methoxy-N-phenyl-1,4-dihydroindeno[2,1-d]pyrazol-3-amine
SMILESCOc1cccc2c1Cc1c(Nc3ccccc3)n[nH]c1-2
InChIInChI=1S/C17H15N3O/c1-21-15-9-5-8-12-13(15)10-14-16(12)19-20-17(14)18-11-6-3-2-4-7-11/h2-9H,10H2,1H3,(H2,18,19,20)
InChIKeyUNYRTXMDRYRVPN-UHFFFAOYSA-N
MW277.33 g/mol
LogP3.73
Rot. Bonds3

About 5-methoxy-N-phenyl-1,4-dihydroindeno[2,1-d]pyrazol-3-amine

5-methoxy-N-phenyl-1,4-dihydroindeno[2,1-d]pyrazol-3-amine (PubChem CID 11536421) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is 5-methoxy-N-phenyl-1,4-dihydroindeno[2,1-d]pyrazol-3-amine.

Molecular Properties

Compound Name5-methoxy-N-phenyl-1,4-dihydroindeno[2,1-d]pyrazol-3-amine
PubChem CID11536421
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC Name5-methoxy-N-phenyl-1,4-dihydroindeno[2,1-d]pyrazol-3-amine
SMILESCOc1cccc2c1Cc1c(Nc3ccccc3)n[nH]c1-2
InChIInChI=1S/C17H15N3O/c1-21-15-9-5-8-12-13(15)10-14-16(12)19-20-17(14)18-11-6-3-2-4-7-11/h2-9H,10H2,1H3,(H2,18,19,20)
InChIKeyUNYRTXMDRYRVPN-UHFFFAOYSA-N
XLogP3.73
TPSA49.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Jnj-10198409
CID 9797370
3-methyl-N-(6,7-dimethoxy-2,4-dihydroindeno[1,2-c]pyrazol-3-yl)phenylamine
CID 10041745
3-trifluoromethyl-N-(6,7-dimethoxy-2,4-dihydroindeno[1,2-c]pyrazol-3-yl)phenylamine
CID 11569396
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,4-dihydroindeno[1,2-c]pyrazol-3-amine
CID 71625259
3-bromo-N-(6,7-dimethoxy-2,4-dihydroindeno[1,2-c]pyrazol-3-yl)phenylamine
CID 10023010
N-(3-methoxyphenyl)-1,4-dihydroindeno[2,1-d]pyrazol-3-amine
CID 10084880
3-chloro-N-(6,7-dimethoxy-2,4-dihydroindeno[1,2-c]pyrazol-3-yl)phenylamine
CID 10246728
3-methoxy-N-(6,7-dimethoxy-2,4-dihydroindeno[1,2-c]pyrazol-3-yl)phenylamine
CID 10359698
3-cyano-N-(6,7-dimethoxy-2,4-dihydroindeno[1,2-c]pyrazol-3-yl)phenylamine
CID 11496022
4-chloro-N-(6,7-dimethoxy-2,4-dihydroindeno[1,2-c]pyrazol-3-yl)phenylamine
CID 11496228
2-chloro-N-(6,7-dimethoxy-2,4-dihydroindeno[1,2-c]pyrazol-3-yl)phenylamine
CID 11510816
(6,7-Dimethoxy-2,4-dihydroindeno[1,2-c]pyrazol-3-yl)-phenyl amine
CID 11525980

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-phenyl-1,4-dihydroindeno[2,1-d]pyrazol-3-amine?
The IUPAC name of 5-methoxy-N-phenyl-1,4-dihydroindeno[2,1-d]pyrazol-3-amine (CID 11536421) is 5-methoxy-N-phenyl-1,4-dihydroindeno[2,1-d]pyrazol-3-amine.
What is the SMILES notation for 5-methoxy-N-phenyl-1,4-dihydroindeno[2,1-d]pyrazol-3-amine?
The canonical SMILES for 5-methoxy-N-phenyl-1,4-dihydroindeno[2,1-d]pyrazol-3-amine is COc1cccc2c1Cc1c(Nc3ccccc3)n[nH]c1-2.
What is the InChIKey of 5-methoxy-N-phenyl-1,4-dihydroindeno[2,1-d]pyrazol-3-amine?
The InChIKey is UNYRTXMDRYRVPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O/c1-21-15-9-5-8-12-13(15)10-14-16(12)19-20-17(14)18-11-6-3-2-4-7-11/h2-9H,10H2,1H3,(H2,18,19,20).
What are the key properties of 5-methoxy-N-phenyl-1,4-dihydroindeno[2,1-d]pyrazol-3-amine?
5-methoxy-N-phenyl-1,4-dihydroindeno[2,1-d]pyrazol-3-amine has a molecular weight of 277.33 g/mol, XLogP of 3.73, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-phenyl-1,4-dihydroindeno[2,1-d]pyrazol-3-amine is sourced from PubChem (CID 11536421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).