N-propyl-2-(quinazolin-4-ylamino)acetamide

C13H16N4O — CID 39165546

IUPACN-propyl-2-(quinazolin-4-ylamino)acetamide
SMILESCCCNC(=O)CNc1ncnc2ccccc12
InChIInChI=1S/C13H16N4O/c1-2-7-14-12(18)8-15-13-10-5-3-4-6-11(10)16-9-17-13/h3-6,9H,2,7-8H2,1H3,(H,14,18)(H,15,16,17)
InChIKeyQVFGXTCRKJMAGS-UHFFFAOYSA-N
MW244.30 g/mol
LogP1.57
Rot. Bonds5

About N-propyl-2-(quinazolin-4-ylamino)acetamide

N-propyl-2-(quinazolin-4-ylamino)acetamide (PubChem CID 39165546) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is N-propyl-2-(quinazolin-4-ylamino)acetamide.

Molecular Properties

Compound NameN-propyl-2-(quinazolin-4-ylamino)acetamide
PubChem CID39165546
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC NameN-propyl-2-(quinazolin-4-ylamino)acetamide
SMILESCCCNC(=O)CNc1ncnc2ccccc12
InChIInChI=1S/C13H16N4O/c1-2-7-14-12(18)8-15-13-10-5-3-4-6-11(10)16-9-17-13/h3-6,9H,2,7-8H2,1H3,(H,14,18)(H,15,16,17)
InChIKeyQVFGXTCRKJMAGS-UHFFFAOYSA-N
XLogP1.57
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[2-(quinazolin-4-ylamino)acetyl]amino]acetic acid
CID 21002376
N-(2-methylpropyl)-2-(quinazolin-4-ylamino)acetamide
CID 49226597
2-[(6-fluoroquinazolin-4-yl)amino]-N-propylacetamide
CID 133383092
2-(quinazolin-4-ylamino)-N-[2-(1,3-thiazol-2-yl)ethyl]acetamide
CID 110446261
N-(pyridin-3-ylmethyl)-2-(quinazolin-4-ylamino)acetamide
CID 110436040
N-(4-tert-butylphenyl)-2-(quinazolin-4-ylamino)acetamide
CID 110437164
2-[(7-aminopyrido[2,3-d]pyrimidin-4-yl)amino]-N-propylacetamide
CID 133407832
N-tert-butyl-3-(quinazolin-4-ylamino)propanamide
CID 115609152
N-[3-(dimethylamino)propyl]-4-(quinazolin-4-ylamino)butanamide
CID 110436139
2-[(5-amino-6-chloropyrimidin-4-yl)amino]-N-propylacetamide
CID 63023413
N-(2-bromoprop-2-enyl)quinazolin-4-amine
CID 115594968
2-[(quinazolin-4-ylamino)methyl]butanoic acid
CID 65226835

Frequently Asked Questions

What is the IUPAC name of N-propyl-2-(quinazolin-4-ylamino)acetamide?
The IUPAC name of N-propyl-2-(quinazolin-4-ylamino)acetamide (CID 39165546) is N-propyl-2-(quinazolin-4-ylamino)acetamide.
What is the SMILES notation for N-propyl-2-(quinazolin-4-ylamino)acetamide?
The canonical SMILES for N-propyl-2-(quinazolin-4-ylamino)acetamide is CCCNC(=O)CNc1ncnc2ccccc12.
What is the InChIKey of N-propyl-2-(quinazolin-4-ylamino)acetamide?
The InChIKey is QVFGXTCRKJMAGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c1-2-7-14-12(18)8-15-13-10-5-3-4-6-11(10)16-9-17-13/h3-6,9H,2,7-8H2,1H3,(H,14,18)(H,15,16,17).
What are the key properties of N-propyl-2-(quinazolin-4-ylamino)acetamide?
N-propyl-2-(quinazolin-4-ylamino)acetamide has a molecular weight of 244.30 g/mol, XLogP of 1.57, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-2-(quinazolin-4-ylamino)acetamide is sourced from PubChem (CID 39165546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).