3-(2-amino-4-propylpyrido[3,2-d]pyrimidin-6-yl)-N,N-dimethylbenzamide

C19H21N5O — CID 68910778

IUPAC3-(2-amino-4-propylpyrido[3,2-d]pyrimidin-6-yl)-N,N-dimethylbenzamide
SMILESCCCc1nc(N)nc2ccc(-c3cccc(C(=O)N(C)C)c3)nc12
InChIInChI=1S/C19H21N5O/c1-4-6-15-17-16(23-19(20)22-15)10-9-14(21-17)12-7-5-8-13(11-12)18(25)24(2)3/h5,7-11H,4,6H2,1-3H3,(H2,20,22,23)
InChIKeyFNLWNUOMWCZATH-UHFFFAOYSA-N
MW335.41 g/mol
LogP2.93
Rot. Bonds4

About 3-(2-amino-4-propylpyrido[3,2-d]pyrimidin-6-yl)-N,N-dimethylbenzamide

3-(2-amino-4-propylpyrido[3,2-d]pyrimidin-6-yl)-N,N-dimethylbenzamide (PubChem CID 68910778) has the molecular formula C19H21N5O and a molecular weight of 335.41 g/mol. Its IUPAC name is 3-(2-amino-4-propylpyrido[3,2-d]pyrimidin-6-yl)-N,N-dimethylbenzamide.

Molecular Properties

Compound Name3-(2-amino-4-propylpyrido[3,2-d]pyrimidin-6-yl)-N,N-dimethylbenzamide
PubChem CID68910778
Molecular FormulaC19H21N5O
Molecular Weight335.41 g/mol
Exact Mass335.17
IUPAC Name3-(2-amino-4-propylpyrido[3,2-d]pyrimidin-6-yl)-N,N-dimethylbenzamide
SMILESCCCc1nc(N)nc2ccc(-c3cccc(C(=O)N(C)C)c3)nc12
InChIInChI=1S/C19H21N5O/c1-4-6-15-17-16(23-19(20)22-15)10-9-14(21-17)12-7-5-8-13(11-12)18(25)24(2)3/h5,7-11H,4,6H2,1-3H3,(H2,20,22,23)
InChIKeyFNLWNUOMWCZATH-UHFFFAOYSA-N
XLogP2.93
TPSA85.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(2-amino-4-propylpyrido[3,2-d]pyrimidin-6-yl)-N-cyclopropylbenzamide
CID 68915273
3-(2-amino-4-phenylpyrido[3,2-d]pyrimidin-6-yl)-N,N-dimethylbenzamide
CID 68913326
3-(2-amino-4-benzylpyrido[3,2-d]pyrimidin-6-yl)-N,N-diethylbenzamide
CID 68915002
6-(6-bromo-3-pyridinyl)-4-propylpyrido[3,2-d]pyrimidin-2-amine
CID 87620464
3-(2-amino-4-benzylpyrido[3,2-d]pyrimidin-6-yl)benzamide
CID 68915324
6-(2-methylsulfanylphenyl)-4-propylpyrido[3,2-d]pyrimidin-2-amine
CID 68913093
6-(4-morpholin-4-ylphenyl)-4-propylpyrido[3,2-d]pyrimidin-2-amine
CID 68913237
3-[3-(dimethylcarbamoyl)phenyl]-N-ethylbenzamide
CID 70972215
3-(2,6-diamino-5-cyanopyrimidin-4-yl)-N,N-dimethylbenzamide
CID 169398285
3-(3-ethylphenyl)-N,N-dimethylbenzamide
CID 20651355
tert-butyl 3-(2-amino-4-phenylpyrido[3,2-d]pyrimidin-6-yl)benzoate
CID 68910825
6-(2-phenylmethoxyphenyl)-4-propylpyrido[3,2-d]pyrimidin-2-amine
CID 68914860

Frequently Asked Questions

What is the IUPAC name of 3-(2-amino-4-propylpyrido[3,2-d]pyrimidin-6-yl)-N,N-dimethylbenzamide?
The IUPAC name of 3-(2-amino-4-propylpyrido[3,2-d]pyrimidin-6-yl)-N,N-dimethylbenzamide (CID 68910778) is 3-(2-amino-4-propylpyrido[3,2-d]pyrimidin-6-yl)-N,N-dimethylbenzamide.
What is the SMILES notation for 3-(2-amino-4-propylpyrido[3,2-d]pyrimidin-6-yl)-N,N-dimethylbenzamide?
The canonical SMILES for 3-(2-amino-4-propylpyrido[3,2-d]pyrimidin-6-yl)-N,N-dimethylbenzamide is CCCc1nc(N)nc2ccc(-c3cccc(C(=O)N(C)C)c3)nc12.
What is the InChIKey of 3-(2-amino-4-propylpyrido[3,2-d]pyrimidin-6-yl)-N,N-dimethylbenzamide?
The InChIKey is FNLWNUOMWCZATH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O/c1-4-6-15-17-16(23-19(20)22-15)10-9-14(21-17)12-7-5-8-13(11-12)18(25)24(2)3/h5,7-11H,4,6H2,1-3H3,(H2,20,22,23).
What are the key properties of 3-(2-amino-4-propylpyrido[3,2-d]pyrimidin-6-yl)-N,N-dimethylbenzamide?
3-(2-amino-4-propylpyrido[3,2-d]pyrimidin-6-yl)-N,N-dimethylbenzamide has a molecular weight of 335.41 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-amino-4-propylpyrido[3,2-d]pyrimidin-6-yl)-N,N-dimethylbenzamide is sourced from PubChem (CID 68910778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).