N-cyclopentyl-2-[(4-oxo-3H-quinazolin-2-yl)methoxy]acetamide

C16H19N3O3 — CID 135427723

IUPACN-cyclopentyl-2-[(4-oxo-3H-quinazolin-2-yl)methoxy]acetamide
SMILESO=C(COCc1nc2ccccc2c(=O)[nH]1)NC1CCCC1
InChIInChI=1S/C16H19N3O3/c20-15(17-11-5-1-2-6-11)10-22-9-14-18-13-8-4-3-7-12(13)16(21)19-14/h3-4,7-8,11H,1-2,5-6,9-10H2,(H,17,20)(H,18,19,21)
InChIKeyLANLQFWCDXYJHI-UHFFFAOYSA-N
MW301.35 g/mol
LogP1.50
Rot. Bonds5

About N-cyclopentyl-2-[(4-oxo-3H-quinazolin-2-yl)methoxy]acetamide

N-cyclopentyl-2-[(4-oxo-3H-quinazolin-2-yl)methoxy]acetamide (PubChem CID 135427723) has the molecular formula C16H19N3O3 and a molecular weight of 301.35 g/mol. Its IUPAC name is N-cyclopentyl-2-[(4-oxo-3H-quinazolin-2-yl)methoxy]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[(4-oxo-3H-quinazolin-2-yl)methoxy]acetamide
PubChem CID135427723
Molecular FormulaC16H19N3O3
Molecular Weight301.35 g/mol
Exact Mass301.14
IUPAC NameN-cyclopentyl-2-[(4-oxo-3H-quinazolin-2-yl)methoxy]acetamide
SMILESO=C(COCc1nc2ccccc2c(=O)[nH]1)NC1CCCC1
InChIInChI=1S/C16H19N3O3/c20-15(17-11-5-1-2-6-11)10-22-9-14-18-13-8-4-3-7-12(13)16(21)19-14/h3-4,7-8,11H,1-2,5-6,9-10H2,(H,17,20)(H,18,19,21)
InChIKeyLANLQFWCDXYJHI-UHFFFAOYSA-N
XLogP1.50
TPSA84.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

ME0328
CID 135566764
Ethyl 4-oxo-3,4-dihydroquinazoline-2-carboxylate
CID 135437466
3-(4-oxo-3H-quinazolin-2-yl)-N-[(1R)-1-phenylethyl]propanamide
CID 136229577
AR-434/41599876
CID 135399149
3-(4-Oxo-3,4-Dihydroquinazolin-2-Yl)-N-[(1s)-1-Phenylpropyl]propanamide
CID 135566841
2-methyl-3-[3-(morpholin-4-yl)propyl]quinazolin-4(3H)-one
CID 1977430
N-(2,2-dimethoxyethyl)-11-oxo-11H-pyrido[2,1-b]quinazoline-8-carboxamide
CID 5053439
2-methoxy-N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)acetamide
CID 6620413
2-[2-cyclopropyl-1-[(3S,5R)-3,5-dimethylpiperazin-1-yl]ethyl]-3-(2-methoxyethyl)quinazolin-4-one
CID 147692304
3-(2-Methoxyethyl)-2-(1-piperazin-1-ylbutyl)quinazolin-4-one
CID 148372331
2-[1-[(3S,5R)-3,5-dimethylpiperazin-1-yl]butyl]-3-(2-methoxyethyl)quinazolin-4-one
CID 153574346
2-[(Methylamino)methyl]-3,4-dihydroquinazolin-4-one
CID 135427619

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[(4-oxo-3H-quinazolin-2-yl)methoxy]acetamide?
The IUPAC name of N-cyclopentyl-2-[(4-oxo-3H-quinazolin-2-yl)methoxy]acetamide (CID 135427723) is N-cyclopentyl-2-[(4-oxo-3H-quinazolin-2-yl)methoxy]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[(4-oxo-3H-quinazolin-2-yl)methoxy]acetamide?
The canonical SMILES for N-cyclopentyl-2-[(4-oxo-3H-quinazolin-2-yl)methoxy]acetamide is O=C(COCc1nc2ccccc2c(=O)[nH]1)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-[(4-oxo-3H-quinazolin-2-yl)methoxy]acetamide?
The InChIKey is LANLQFWCDXYJHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3/c20-15(17-11-5-1-2-6-11)10-22-9-14-18-13-8-4-3-7-12(13)16(21)19-14/h3-4,7-8,11H,1-2,5-6,9-10H2,(H,17,20)(H,18,19,21).
What are the key properties of N-cyclopentyl-2-[(4-oxo-3H-quinazolin-2-yl)methoxy]acetamide?
N-cyclopentyl-2-[(4-oxo-3H-quinazolin-2-yl)methoxy]acetamide has a molecular weight of 301.35 g/mol, XLogP of 1.50, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[(4-oxo-3H-quinazolin-2-yl)methoxy]acetamide is sourced from PubChem (CID 135427723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).