N-(3-pyrazol-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine

C18H17N3 — CID 43740035

IUPACN-(3-pyrazol-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine
SMILESc1cc(NC2Cc3ccccc3C2)cc(-n2cccn2)c1
InChIInChI=1S/C18H17N3/c1-2-6-15-12-17(11-14(15)5-1)20-16-7-3-8-18(13-16)21-10-4-9-19-21/h1-10,13,17,20H,11-12H2
InChIKeyRYRNNIYFGMJWCG-UHFFFAOYSA-N
MW275.36 g/mol
LogP3.45
Rot. Bonds3

About N-(3-pyrazol-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine

N-(3-pyrazol-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine (PubChem CID 43740035) has the molecular formula C18H17N3 and a molecular weight of 275.36 g/mol. Its IUPAC name is N-(3-pyrazol-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine.

Molecular Properties

Compound NameN-(3-pyrazol-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine
PubChem CID43740035
Molecular FormulaC18H17N3
Molecular Weight275.36 g/mol
Exact Mass275.14
IUPAC NameN-(3-pyrazol-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine
SMILESc1cc(NC2Cc3ccccc3C2)cc(-n2cccn2)c1
InChIInChI=1S/C18H17N3/c1-2-6-15-12-17(11-14(15)5-1)20-16-7-3-8-18(13-16)21-10-4-9-19-21/h1-10,13,17,20H,11-12H2
InChIKeyRYRNNIYFGMJWCG-UHFFFAOYSA-N
XLogP3.45
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methylcyclobutyl)-3-pyrazol-1-ylaniline
CID 104860198
1-cyclopropyl-N-(3-pyrazol-1-ylphenyl)pyrrolidin-3-amine
CID 62981651
1-propan-2-yl-N-(3-pyrazol-1-ylphenyl)piperidin-4-amine
CID 43739937
N-(3-pyrrolidin-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine
CID 60942193
(3R)-N-(3-pyrazol-1-ylphenyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CID 131935601
N-(dicyclopropylmethyl)-3-pyrazol-1-ylaniline
CID 43740005
N-[(1S,2R)-2-(2,3-dihydro-1H-inden-2-ylamino)cyclobutyl]-3-pyrazol-1-ylbenzamide
CID 56915580
N-(3-pyrazol-1-ylphenyl)pyridin-2-amine
CID 162630753
2-chloro-N-(3-pyrazol-1-ylphenyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-4-amine
CID 81235453
N-(3-pyrazol-1-ylphenyl)pyridin-4-amine
CID 162626187
N-(3-chlorophenyl)-3-pyrazol-1-ylaniline
CID 162634741
N-(3-methylbutan-2-yl)-3-pyrazol-1-ylaniline
CID 43739992

Frequently Asked Questions

What is the IUPAC name of N-(3-pyrazol-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine?
The IUPAC name of N-(3-pyrazol-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine (CID 43740035) is N-(3-pyrazol-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine.
What is the SMILES notation for N-(3-pyrazol-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine?
The canonical SMILES for N-(3-pyrazol-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine is c1cc(NC2Cc3ccccc3C2)cc(-n2cccn2)c1.
What is the InChIKey of N-(3-pyrazol-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine?
The InChIKey is RYRNNIYFGMJWCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3/c1-2-6-15-12-17(11-14(15)5-1)20-16-7-3-8-18(13-16)21-10-4-9-19-21/h1-10,13,17,20H,11-12H2.
What are the key properties of N-(3-pyrazol-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine?
N-(3-pyrazol-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine has a molecular weight of 275.36 g/mol, XLogP of 3.45, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-pyrazol-1-ylphenyl)-2,3-dihydro-1H-inden-2-amine is sourced from PubChem (CID 43740035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).