(4-amino-5-cyclopropyl-1H-pyrazol-3-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone

C16H18N4O — CID 62075475

IUPAC(4-amino-5-cyclopropyl-1H-pyrazol-3-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
SMILESCC1Cc2ccccc2N1C(=O)c1n[nH]c(C2CC2)c1N
InChIInChI=1S/C16H18N4O/c1-9-8-11-4-2-3-5-12(11)20(9)16(21)15-13(17)14(18-19-15)10-6-7-10/h2-5,9-10H,6-8,17H2,1H3,(H,18,19)
InChIKeyKDZZBHONWJZISE-UHFFFAOYSA-N
MW282.35 g/mol
LogP2.46
Rot. Bonds2

About (4-amino-5-cyclopropyl-1H-pyrazol-3-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone

(4-amino-5-cyclopropyl-1H-pyrazol-3-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone (PubChem CID 62075475) has the molecular formula C16H18N4O and a molecular weight of 282.35 g/mol. Its IUPAC name is (4-amino-5-cyclopropyl-1H-pyrazol-3-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone.

Molecular Properties

Compound Name(4-amino-5-cyclopropyl-1H-pyrazol-3-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
PubChem CID62075475
Molecular FormulaC16H18N4O
Molecular Weight282.35 g/mol
Exact Mass282.15
IUPAC Name(4-amino-5-cyclopropyl-1H-pyrazol-3-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
SMILESCC1Cc2ccccc2N1C(=O)c1n[nH]c(C2CC2)c1N
InChIInChI=1S/C16H18N4O/c1-9-8-11-4-2-3-5-12(11)20(9)16(21)15-13(17)14(18-19-15)10-6-7-10/h2-5,9-10H,6-8,17H2,1H3,(H,18,19)
InChIKeyKDZZBHONWJZISE-UHFFFAOYSA-N
XLogP2.46
TPSA75.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(4-amino-5-cyclopropyl-1H-pyrazol-3-yl)-(1,3-dihydroisoindol-2-yl)methanone
CID 62204451
(4-amino-5-methyl-1H-pyrazol-3-yl)-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 62081386
[(2R)-2-methyl-2,3-dihydroindol-1-yl]-(5-nitro-1H-indazol-3-yl)methanone
CID 35414080
(2-methyl-2,3-dihydroindol-1-yl)-(5-propan-2-yl-1H-pyrazol-3-yl)methanone
CID 47322681
(2-methyl-2,3-dihydroindol-1-yl)-phenylmethanone
CID 15274130
(4-amino-5-cyclopropyl-1H-pyrazol-3-yl)-(4-methylpiperidin-1-yl)methanone
CID 55034216
(2-methyl-2,3-dihydroindol-1-yl)-[1-methyl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)pyrazol-4-yl]methanone
CID 44824100
(2-amino-3-fluoro-4-pyridinyl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 105384137
6-(2-methyl-2,3-dihydroindole-1-carbonyl)-1H-pyridin-2-one
CID 107362801
[(2S)-2-methyl-2,3-dihydroindol-1-yl]-(5-methylpyrazin-2-yl)methanone
CID 93240954
[(2R)-2-methyl-2,3-dihydroindol-1-yl]-(5-methyl-2-phenyltriazol-4-yl)methanone
CID 26910878
(4-amino-5-cyclopropyl-1H-pyrazol-3-yl)-(2-ethyl-5-methylpyrrolidin-1-yl)methanone
CID 83217635

Frequently Asked Questions

What is the IUPAC name of (4-amino-5-cyclopropyl-1H-pyrazol-3-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone?
The IUPAC name of (4-amino-5-cyclopropyl-1H-pyrazol-3-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone (CID 62075475) is (4-amino-5-cyclopropyl-1H-pyrazol-3-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone.
What is the SMILES notation for (4-amino-5-cyclopropyl-1H-pyrazol-3-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone?
The canonical SMILES for (4-amino-5-cyclopropyl-1H-pyrazol-3-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone is CC1Cc2ccccc2N1C(=O)c1n[nH]c(C2CC2)c1N.
What is the InChIKey of (4-amino-5-cyclopropyl-1H-pyrazol-3-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone?
The InChIKey is KDZZBHONWJZISE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O/c1-9-8-11-4-2-3-5-12(11)20(9)16(21)15-13(17)14(18-19-15)10-6-7-10/h2-5,9-10H,6-8,17H2,1H3,(H,18,19).
What are the key properties of (4-amino-5-cyclopropyl-1H-pyrazol-3-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone?
(4-amino-5-cyclopropyl-1H-pyrazol-3-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone has a molecular weight of 282.35 g/mol, XLogP of 2.46, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-5-cyclopropyl-1H-pyrazol-3-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone is sourced from PubChem (CID 62075475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).