N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-4-ylquinazolin-4-amine

C19H16N6 — CID 70693802

IUPACN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-4-ylquinazolin-4-amine
SMILESc1ccc2c(Nc3cc(C4CC4)[nH]n3)nc(-c3ccncc3)nc2c1
InChIInChI=1S/C19H16N6/c1-2-4-15-14(3-1)19(22-17-11-16(24-25-17)12-5-6-12)23-18(21-15)13-7-9-20-10-8-13/h1-4,7-12H,5-6H2,(H2,21,22,23,24,25)
InChIKeyZUTXVYDXDZGDRK-UHFFFAOYSA-N
MW328.38 g/mol
LogP4.04
Rot. Bonds4

About N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-4-ylquinazolin-4-amine

N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-4-ylquinazolin-4-amine (PubChem CID 70693802) has the molecular formula C19H16N6 and a molecular weight of 328.38 g/mol. Its IUPAC name is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-4-ylquinazolin-4-amine.

Molecular Properties

Compound NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-4-ylquinazolin-4-amine
PubChem CID70693802
Molecular FormulaC19H16N6
Molecular Weight328.38 g/mol
Exact Mass328.14
IUPAC NameN-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-4-ylquinazolin-4-amine
SMILESc1ccc2c(Nc3cc(C4CC4)[nH]n3)nc(-c3ccncc3)nc2c1
InChIInChI=1S/C19H16N6/c1-2-4-15-14(3-1)19(22-17-11-16(24-25-17)12-5-6-12)23-18(21-15)13-7-9-20-10-8-13/h1-4,7-12H,5-6H2,(H2,21,22,23,24,25)
InChIKeyZUTXVYDXDZGDRK-UHFFFAOYSA-N
XLogP4.04
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.38
LogP ≤ 54.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-4-ylquinazolin-4-amine?
The IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-4-ylquinazolin-4-amine (CID 70693802) is N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-4-ylquinazolin-4-amine.
What is the SMILES notation for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-4-ylquinazolin-4-amine?
The canonical SMILES for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-4-ylquinazolin-4-amine is c1ccc2c(Nc3cc(C4CC4)[nH]n3)nc(-c3ccncc3)nc2c1.
What is the InChIKey of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-4-ylquinazolin-4-amine?
The InChIKey is ZUTXVYDXDZGDRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N6/c1-2-4-15-14(3-1)19(22-17-11-16(24-25-17)12-5-6-12)23-18(21-15)13-7-9-20-10-8-13/h1-4,7-12H,5-6H2,(H2,21,22,23,24,25).
What are the key properties of N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-4-ylquinazolin-4-amine?
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-4-ylquinazolin-4-amine has a molecular weight of 328.38 g/mol, XLogP of 4.04, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-pyridin-4-ylquinazolin-4-amine is sourced from PubChem (CID 70693802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).