N-(2-morpholin-4-ylethyl)-6-pyridin-3-ylquinazolin-4-amine

C19H21N5O — CID 3234983

IUPACN-(2-morpholin-4-ylethyl)-6-pyridin-3-ylquinazolin-4-amine
SMILESc1cncc(-c2ccc3ncnc(NCCN4CCOCC4)c3c2)c1
InChIInChI=1S/C19H21N5O/c1-2-16(13-20-5-1)15-3-4-18-17(12-15)19(23-14-22-18)21-6-7-24-8-10-25-11-9-24/h1-5,12-14H,6-11H2,(H,21,22,23)
InChIKeyHYGHWJDOWZXABZ-UHFFFAOYSA-N
MW335.41 g/mol
LogP2.44
Rot. Bonds5

About N-(2-morpholin-4-ylethyl)-6-pyridin-3-ylquinazolin-4-amine

N-(2-morpholin-4-ylethyl)-6-pyridin-3-ylquinazolin-4-amine (PubChem CID 3234983) has the molecular formula C19H21N5O and a molecular weight of 335.41 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-6-pyridin-3-ylquinazolin-4-amine.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-6-pyridin-3-ylquinazolin-4-amine
PubChem CID3234983
Molecular FormulaC19H21N5O
Molecular Weight335.41 g/mol
Exact Mass335.17
IUPAC NameN-(2-morpholin-4-ylethyl)-6-pyridin-3-ylquinazolin-4-amine
SMILESc1cncc(-c2ccc3ncnc(NCCN4CCOCC4)c3c2)c1
InChIInChI=1S/C19H21N5O/c1-2-16(13-20-5-1)15-3-4-18-17(12-15)19(23-14-22-18)21-6-7-24-8-10-25-11-9-24/h1-5,12-14H,6-11H2,(H,21,22,23)
InChIKeyHYGHWJDOWZXABZ-UHFFFAOYSA-N
XLogP2.44
TPSA63.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-6-pyridin-3-ylquinazolin-4-amine?
The IUPAC name of N-(2-morpholin-4-ylethyl)-6-pyridin-3-ylquinazolin-4-amine (CID 3234983) is N-(2-morpholin-4-ylethyl)-6-pyridin-3-ylquinazolin-4-amine.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-6-pyridin-3-ylquinazolin-4-amine?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-6-pyridin-3-ylquinazolin-4-amine is c1cncc(-c2ccc3ncnc(NCCN4CCOCC4)c3c2)c1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-6-pyridin-3-ylquinazolin-4-amine?
The InChIKey is HYGHWJDOWZXABZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O/c1-2-16(13-20-5-1)15-3-4-18-17(12-15)19(23-14-22-18)21-6-7-24-8-10-25-11-9-24/h1-5,12-14H,6-11H2,(H,21,22,23).
What are the key properties of N-(2-morpholin-4-ylethyl)-6-pyridin-3-ylquinazolin-4-amine?
N-(2-morpholin-4-ylethyl)-6-pyridin-3-ylquinazolin-4-amine has a molecular weight of 335.41 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-6-pyridin-3-ylquinazolin-4-amine is sourced from PubChem (CID 3234983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).