2-ethoxy-N-(4-pyrrolidin-1-ylquinazolin-7-yl)acetamide

C16H20N4O2 — CID 53137372

IUPAC2-ethoxy-N-(4-pyrrolidin-1-ylquinazolin-7-yl)acetamide
SMILESCCOCC(=O)Nc1ccc2c(N3CCCC3)ncnc2c1
InChIInChI=1S/C16H20N4O2/c1-2-22-10-15(21)19-12-5-6-13-14(9-12)17-11-18-16(13)20-7-3-4-8-20/h5-6,9,11H,2-4,7-8,10H2,1H3,(H,19,21)
InChIKeyGMBKIJNIGMZKDG-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.20
Rot. Bonds5

About 2-ethoxy-N-(4-pyrrolidin-1-ylquinazolin-7-yl)acetamide

2-ethoxy-N-(4-pyrrolidin-1-ylquinazolin-7-yl)acetamide (PubChem CID 53137372) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is 2-ethoxy-N-(4-pyrrolidin-1-ylquinazolin-7-yl)acetamide.

Molecular Properties

Compound Name2-ethoxy-N-(4-pyrrolidin-1-ylquinazolin-7-yl)acetamide
PubChem CID53137372
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC Name2-ethoxy-N-(4-pyrrolidin-1-ylquinazolin-7-yl)acetamide
SMILESCCOCC(=O)Nc1ccc2c(N3CCCC3)ncnc2c1
InChIInChI=1S/C16H20N4O2/c1-2-22-10-15(21)19-12-5-6-13-14(9-12)17-11-18-16(13)20-7-3-4-8-20/h5-6,9,11H,2-4,7-8,10H2,1H3,(H,19,21)
InChIKeyGMBKIJNIGMZKDG-UHFFFAOYSA-N
XLogP2.20
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-N-(4-pyrrolidin-1-ylquinazolin-7-yl)benzamide
CID 53137404
2-(4-fluorophenyl)-N-(4-pyrrolidin-1-ylquinazolin-6-yl)acetamide
CID 53140564
3-(dimethylamino)-N-(4-piperidin-1-ylquinazolin-7-yl)benzamide
CID 53137440
N-butan-2-yl-4-pyrrolidin-1-ylquinazoline-6-carboxamide
CID 71842520
4-(azepan-1-yl)-7-methoxyquinazoline
CID 110433303
2-[4-(azepan-1-yl)pyrazolo[5,4-d]pyrimidin-1-yl]-N-(3-fluoro-4-methylphenyl)acetamide
CID 53196498
N-[(2-ethoxyphenyl)methyl]-4-piperidin-1-ylquinazoline-6-carboxamide
CID 71842381
[2-(3,4-diethoxyanilino)-2-oxoethyl] 2-pyrrolidin-1-ylpyridine-3-carboxylate
CID 27045677
5-chloro-2-methoxy-N-(4-pyrrolidin-1-ylquinazolin-6-yl)benzamide
CID 53140541
2-ethoxy-N-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]acetamide
CID 52557964
4-(azepan-1-yl)quinazolin-7-amine
CID 65336850
4-(azocan-1-yl)quinazolin-7-amine
CID 65337382

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(4-pyrrolidin-1-ylquinazolin-7-yl)acetamide?
The IUPAC name of 2-ethoxy-N-(4-pyrrolidin-1-ylquinazolin-7-yl)acetamide (CID 53137372) is 2-ethoxy-N-(4-pyrrolidin-1-ylquinazolin-7-yl)acetamide.
What is the SMILES notation for 2-ethoxy-N-(4-pyrrolidin-1-ylquinazolin-7-yl)acetamide?
The canonical SMILES for 2-ethoxy-N-(4-pyrrolidin-1-ylquinazolin-7-yl)acetamide is CCOCC(=O)Nc1ccc2c(N3CCCC3)ncnc2c1.
What is the InChIKey of 2-ethoxy-N-(4-pyrrolidin-1-ylquinazolin-7-yl)acetamide?
The InChIKey is GMBKIJNIGMZKDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-2-22-10-15(21)19-12-5-6-13-14(9-12)17-11-18-16(13)20-7-3-4-8-20/h5-6,9,11H,2-4,7-8,10H2,1H3,(H,19,21).
What are the key properties of 2-ethoxy-N-(4-pyrrolidin-1-ylquinazolin-7-yl)acetamide?
2-ethoxy-N-(4-pyrrolidin-1-ylquinazolin-7-yl)acetamide has a molecular weight of 300.36 g/mol, XLogP of 2.20, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(4-pyrrolidin-1-ylquinazolin-7-yl)acetamide is sourced from PubChem (CID 53137372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).