N-(5-acetamido-2-methoxyphenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide

C18H26N4O4 — CID 75119601

IUPACN-(5-acetamido-2-methoxyphenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide
SMILESCCCC1CC(=O)N(CC(=O)Nc2cc(NC(C)=O)ccc2OC)CN1
InChIInChI=1S/C18H26N4O4/c1-4-5-13-9-18(25)22(11-19-13)10-17(24)21-15-8-14(20-12(2)23)6-7-16(15)26-3/h6-8,13,19H,4-5,9-11H2,1-3H3,(H,20,23)(H,21,24)
InChIKeyXQYKJEPNYPPLMR-UHFFFAOYSA-N
MW362.43 g/mol
LogP1.54
Rot. Bonds7

About N-(5-acetamido-2-methoxyphenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide

N-(5-acetamido-2-methoxyphenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide (PubChem CID 75119601) has the molecular formula C18H26N4O4 and a molecular weight of 362.43 g/mol. Its IUPAC name is N-(5-acetamido-2-methoxyphenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide.

Molecular Properties

Compound NameN-(5-acetamido-2-methoxyphenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide
PubChem CID75119601
Molecular FormulaC18H26N4O4
Molecular Weight362.43 g/mol
Exact Mass362.20
IUPAC NameN-(5-acetamido-2-methoxyphenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide
SMILESCCCC1CC(=O)N(CC(=O)Nc2cc(NC(C)=O)ccc2OC)CN1
InChIInChI=1S/C18H26N4O4/c1-4-5-13-9-18(25)22(11-19-13)10-17(24)21-15-8-14(20-12(2)23)6-7-16(15)26-3/h6-8,13,19H,4-5,9-11H2,1-3H3,(H,20,23)(H,21,24)
InChIKeyXQYKJEPNYPPLMR-UHFFFAOYSA-N
XLogP1.54
TPSA99.77 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.43
LogP ≤ 51.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-chlorophenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide
CID 75119542
4-[[2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetyl]amino]benzamide
CID 75119592
N-(2-methyl-4-nitrophenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide
CID 75119511
N-(5-acetamido-2-methoxyphenyl)-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)acetamide
CID 9342184
N-(5-acetamido-2-methoxyphenyl)-2-(azocan-1-yl)acetamide
CID 8680244
N-(5-acetamido-2-methoxyphenyl)-2-(6-chloro-2-oxo-3H-1,4-benzoxazin-4-yl)acetamide
CID 56761541
N-(5-acetamido-2-methoxyphenyl)-3-chloropropanamide
CID 43236542
N-(5-acetamido-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride
CID 119680223
[2-(5-acetamido-2-methoxyanilino)-2-oxoethyl] propanoate
CID 9015180
N-(5-acetamido-2-methoxyphenyl)-2-[(2R)-2-methylmorpholin-4-yl]acetamide
CID 31502105
N-(5-acetamido-2-methoxyphenyl)-2-(4-chlorophenyl)sulfanylacetamide
CID 26552817
N-(5-acetamido-2-methoxyphenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]acetamide
CID 3703737

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2-methoxyphenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide?
The IUPAC name of N-(5-acetamido-2-methoxyphenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide (CID 75119601) is N-(5-acetamido-2-methoxyphenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide.
What is the SMILES notation for N-(5-acetamido-2-methoxyphenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide?
The canonical SMILES for N-(5-acetamido-2-methoxyphenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide is CCCC1CC(=O)N(CC(=O)Nc2cc(NC(C)=O)ccc2OC)CN1.
What is the InChIKey of N-(5-acetamido-2-methoxyphenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide?
The InChIKey is XQYKJEPNYPPLMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O4/c1-4-5-13-9-18(25)22(11-19-13)10-17(24)21-15-8-14(20-12(2)23)6-7-16(15)26-3/h6-8,13,19H,4-5,9-11H2,1-3H3,(H,20,23)(H,21,24).
What are the key properties of N-(5-acetamido-2-methoxyphenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide?
N-(5-acetamido-2-methoxyphenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide has a molecular weight of 362.43 g/mol, XLogP of 1.54, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2-methoxyphenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide is sourced from PubChem (CID 75119601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).