N-(2-morpholin-4-ylpropyl)-2-pyridin-4-ylquinazolin-4-amine

C20H23N5O — CID 166205965

IUPACN-(2-morpholin-4-ylpropyl)-2-pyridin-4-ylquinazolin-4-amine
SMILESCC(CNc1nc(-c2ccncc2)nc2ccccc12)N1CCOCC1
InChIInChI=1S/C20H23N5O/c1-15(25-10-12-26-13-11-25)14-22-20-17-4-2-3-5-18(17)23-19(24-20)16-6-8-21-9-7-16/h2-9,15H,10-14H2,1H3,(H,22,23,24)
InChIKeyANZIECMEWKUEBM-UHFFFAOYSA-N
MW349.44 g/mol
LogP2.82
Rot. Bonds5

About N-(2-morpholin-4-ylpropyl)-2-pyridin-4-ylquinazolin-4-amine

N-(2-morpholin-4-ylpropyl)-2-pyridin-4-ylquinazolin-4-amine (PubChem CID 166205965) has the molecular formula C20H23N5O and a molecular weight of 349.44 g/mol. Its IUPAC name is N-(2-morpholin-4-ylpropyl)-2-pyridin-4-ylquinazolin-4-amine.

Molecular Properties

Compound NameN-(2-morpholin-4-ylpropyl)-2-pyridin-4-ylquinazolin-4-amine
PubChem CID166205965
Molecular FormulaC20H23N5O
Molecular Weight349.44 g/mol
Exact Mass349.19
IUPAC NameN-(2-morpholin-4-ylpropyl)-2-pyridin-4-ylquinazolin-4-amine
SMILESCC(CNc1nc(-c2ccncc2)nc2ccccc12)N1CCOCC1
InChIInChI=1S/C20H23N5O/c1-15(25-10-12-26-13-11-25)14-22-20-17-4-2-3-5-18(17)23-19(24-20)16-6-8-21-9-7-16/h2-9,15H,10-14H2,1H3,(H,22,23,24)
InChIKeyANZIECMEWKUEBM-UHFFFAOYSA-N
XLogP2.82
TPSA63.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.44
LogP ≤ 52.82
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-ylpropyl)-2-pyridin-4-ylquinazolin-4-amine?
The IUPAC name of N-(2-morpholin-4-ylpropyl)-2-pyridin-4-ylquinazolin-4-amine (CID 166205965) is N-(2-morpholin-4-ylpropyl)-2-pyridin-4-ylquinazolin-4-amine.
What is the SMILES notation for N-(2-morpholin-4-ylpropyl)-2-pyridin-4-ylquinazolin-4-amine?
The canonical SMILES for N-(2-morpholin-4-ylpropyl)-2-pyridin-4-ylquinazolin-4-amine is CC(CNc1nc(-c2ccncc2)nc2ccccc12)N1CCOCC1.
What is the InChIKey of N-(2-morpholin-4-ylpropyl)-2-pyridin-4-ylquinazolin-4-amine?
The InChIKey is ANZIECMEWKUEBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O/c1-15(25-10-12-26-13-11-25)14-22-20-17-4-2-3-5-18(17)23-19(24-20)16-6-8-21-9-7-16/h2-9,15H,10-14H2,1H3,(H,22,23,24).
What are the key properties of N-(2-morpholin-4-ylpropyl)-2-pyridin-4-ylquinazolin-4-amine?
N-(2-morpholin-4-ylpropyl)-2-pyridin-4-ylquinazolin-4-amine has a molecular weight of 349.44 g/mol, XLogP of 2.82, 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-ylpropyl)-2-pyridin-4-ylquinazolin-4-amine is sourced from PubChem (CID 166205965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).