N-(4-methoxyphenyl)-7-methyl-1,2-dihydroindeno[1,2-c]pyrazol-3-amine

C18H17N3O — CID 90905359

IUPACN-(4-methoxyphenyl)-7-methyl-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
SMILESCOc1ccc(Nc2[nH][nH]c3c4cc(C)ccc4cc2-3)cc1
InChIInChI=1S/C18H17N3O/c1-11-3-4-12-10-16-17(15(12)9-11)20-21-18(16)19-13-5-7-14(22-2)8-6-13/h3-10,19-21H,1-2H3
InChIKeyYASMQEYMYDTGOI-UHFFFAOYSA-N
MW291.35 g/mol
LogP4.66
Rot. Bonds3

About N-(4-methoxyphenyl)-7-methyl-1,2-dihydroindeno[1,2-c]pyrazol-3-amine

N-(4-methoxyphenyl)-7-methyl-1,2-dihydroindeno[1,2-c]pyrazol-3-amine (PubChem CID 90905359) has the molecular formula C18H17N3O and a molecular weight of 291.35 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-7-methyl-1,2-dihydroindeno[1,2-c]pyrazol-3-amine.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-7-methyl-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
PubChem CID90905359
Molecular FormulaC18H17N3O
Molecular Weight291.35 g/mol
Exact Mass291.14
IUPAC NameN-(4-methoxyphenyl)-7-methyl-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
SMILESCOc1ccc(Nc2[nH][nH]c3c4cc(C)ccc4cc2-3)cc1
InChIInChI=1S/C18H17N3O/c1-11-3-4-12-10-16-17(15(12)9-11)20-21-18(16)19-13-5-7-14(22-2)8-6-13/h3-10,19-21H,1-2H3
InChIKeyYASMQEYMYDTGOI-UHFFFAOYSA-N
XLogP4.66
TPSA52.84 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 54.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-7-methyl-1,2-dihydroindeno[1,2-c]pyrazol-3-amine?
The IUPAC name of N-(4-methoxyphenyl)-7-methyl-1,2-dihydroindeno[1,2-c]pyrazol-3-amine (CID 90905359) is N-(4-methoxyphenyl)-7-methyl-1,2-dihydroindeno[1,2-c]pyrazol-3-amine.
What is the SMILES notation for N-(4-methoxyphenyl)-7-methyl-1,2-dihydroindeno[1,2-c]pyrazol-3-amine?
The canonical SMILES for N-(4-methoxyphenyl)-7-methyl-1,2-dihydroindeno[1,2-c]pyrazol-3-amine is COc1ccc(Nc2[nH][nH]c3c4cc(C)ccc4cc2-3)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-7-methyl-1,2-dihydroindeno[1,2-c]pyrazol-3-amine?
The InChIKey is YASMQEYMYDTGOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O/c1-11-3-4-12-10-16-17(15(12)9-11)20-21-18(16)19-13-5-7-14(22-2)8-6-13/h3-10,19-21H,1-2H3.
What are the key properties of N-(4-methoxyphenyl)-7-methyl-1,2-dihydroindeno[1,2-c]pyrazol-3-amine?
N-(4-methoxyphenyl)-7-methyl-1,2-dihydroindeno[1,2-c]pyrazol-3-amine has a molecular weight of 291.35 g/mol, XLogP of 4.66, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-7-methyl-1,2-dihydroindeno[1,2-c]pyrazol-3-amine is sourced from PubChem (CID 90905359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).