N-propan-2-yl-2-[(2-pyridin-3-ylquinazolin-4-yl)amino]acetamide

C18H19N5O — CID 8567435

IUPACN-propan-2-yl-2-[(2-pyridin-3-ylquinazolin-4-yl)amino]acetamide
SMILESCC(C)NC(=O)CNc1nc(-c2cccnc2)nc2ccccc12
InChIInChI=1S/C18H19N5O/c1-12(2)21-16(24)11-20-18-14-7-3-4-8-15(14)22-17(23-18)13-6-5-9-19-10-13/h3-10,12H,11H2,1-2H3,(H,21,24)(H,20,22,23)
InChIKeyDIZJWZBOXOJODM-UHFFFAOYSA-N
MW321.38 g/mol
LogP2.63
Rot. Bonds5

About N-propan-2-yl-2-[(2-pyridin-3-ylquinazolin-4-yl)amino]acetamide

N-propan-2-yl-2-[(2-pyridin-3-ylquinazolin-4-yl)amino]acetamide (PubChem CID 8567435) has the molecular formula C18H19N5O and a molecular weight of 321.38 g/mol. Its IUPAC name is N-propan-2-yl-2-[(2-pyridin-3-ylquinazolin-4-yl)amino]acetamide.

Molecular Properties

Compound NameN-propan-2-yl-2-[(2-pyridin-3-ylquinazolin-4-yl)amino]acetamide
PubChem CID8567435
Molecular FormulaC18H19N5O
Molecular Weight321.38 g/mol
Exact Mass321.16
IUPAC NameN-propan-2-yl-2-[(2-pyridin-3-ylquinazolin-4-yl)amino]acetamide
SMILESCC(C)NC(=O)CNc1nc(-c2cccnc2)nc2ccccc12
InChIInChI=1S/C18H19N5O/c1-12(2)21-16(24)11-20-18-14-7-3-4-8-15(14)22-17(23-18)13-6-5-9-19-10-13/h3-10,12H,11H2,1-2H3,(H,21,24)(H,20,22,23)
InChIKeyDIZJWZBOXOJODM-UHFFFAOYSA-N
XLogP2.63
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(furan-2-ylmethyl)-2-[(2-pyridin-3-ylquinazolin-4-yl)amino]acetamide
CID 18095906
N-prop-2-ynyl-2-pyridin-3-ylquinazolin-4-amine
CID 9251922
N-[(2S)-3-methylbutan-2-yl]-2-pyridin-3-ylquinazolin-4-amine
CID 9111435
N-methyl-2-pyridin-3-ylquinazolin-4-amine;propane
CID 142952952
N-[(2-methylphenyl)methyl]-2-pyridin-3-ylquinazolin-4-amine
CID 9251567
2-[(2-phenylquinazolin-4-yl)amino]-N-prop-2-ynylacetamide
CID 133278092
N-[[1-(methylsulfonylmethyl)cyclopropyl]methyl]-2-pyridin-3-ylquinazolin-4-amine
CID 133344251
2-[(2-phenylquinazolin-4-yl)amino]acetate
CID 4053821
N-(2-cyclopropylethyl)-2-pyridin-3-ylquinazolin-4-amine
CID 133324203
N-[(5-methylpyrazin-2-yl)methyl]-2-pyridin-3-ylquinazolin-4-amine
CID 3234103
N-methyl-N-[4-[[(2-pyridin-3-ylquinazolin-4-yl)amino]methyl]phenyl]pyridine-4-carboxamide
CID 133316378
1-(1-methylpyrazol-4-yl)-2-[(2-pyridin-3-ylquinazolin-4-yl)amino]ethanol
CID 133323500

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-2-[(2-pyridin-3-ylquinazolin-4-yl)amino]acetamide?
The IUPAC name of N-propan-2-yl-2-[(2-pyridin-3-ylquinazolin-4-yl)amino]acetamide (CID 8567435) is N-propan-2-yl-2-[(2-pyridin-3-ylquinazolin-4-yl)amino]acetamide.
What is the SMILES notation for N-propan-2-yl-2-[(2-pyridin-3-ylquinazolin-4-yl)amino]acetamide?
The canonical SMILES for N-propan-2-yl-2-[(2-pyridin-3-ylquinazolin-4-yl)amino]acetamide is CC(C)NC(=O)CNc1nc(-c2cccnc2)nc2ccccc12.
What is the InChIKey of N-propan-2-yl-2-[(2-pyridin-3-ylquinazolin-4-yl)amino]acetamide?
The InChIKey is DIZJWZBOXOJODM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O/c1-12(2)21-16(24)11-20-18-14-7-3-4-8-15(14)22-17(23-18)13-6-5-9-19-10-13/h3-10,12H,11H2,1-2H3,(H,21,24)(H,20,22,23).
What are the key properties of N-propan-2-yl-2-[(2-pyridin-3-ylquinazolin-4-yl)amino]acetamide?
N-propan-2-yl-2-[(2-pyridin-3-ylquinazolin-4-yl)amino]acetamide has a molecular weight of 321.38 g/mol, XLogP of 2.63, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-2-[(2-pyridin-3-ylquinazolin-4-yl)amino]acetamide is sourced from PubChem (CID 8567435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).