N-hydroxy-2-[2-oxo-3-[4-(pyridin-2-ylmethoxy)phenyl]-1,3-diazinan-1-yl]propanamide

C19H22N4O4 — CID 44574447

IUPACN-hydroxy-2-[2-oxo-3-[4-(pyridin-2-ylmethoxy)phenyl]-1,3-diazinan-1-yl]propanamide
SMILESCC(C(=O)NO)N1CCCN(c2ccc(OCc3ccccn3)cc2)C1=O
InChIInChI=1S/C19H22N4O4/c1-14(18(24)21-26)22-11-4-12-23(19(22)25)16-6-8-17(9-7-16)27-13-15-5-2-3-10-20-15/h2-3,5-10,14,26H,4,11-13H2,1H3,(H,21,24)
InChIKeyCXGYASCJPNLMRT-UHFFFAOYSA-N
MW370.41 g/mol
LogP2.19
Rot. Bonds6

About N-hydroxy-2-[2-oxo-3-[4-(pyridin-2-ylmethoxy)phenyl]-1,3-diazinan-1-yl]propanamide

N-hydroxy-2-[2-oxo-3-[4-(pyridin-2-ylmethoxy)phenyl]-1,3-diazinan-1-yl]propanamide (PubChem CID 44574447) has the molecular formula C19H22N4O4 and a molecular weight of 370.41 g/mol. Its IUPAC name is N-hydroxy-2-[2-oxo-3-[4-(pyridin-2-ylmethoxy)phenyl]-1,3-diazinan-1-yl]propanamide.

Molecular Properties

Compound NameN-hydroxy-2-[2-oxo-3-[4-(pyridin-2-ylmethoxy)phenyl]-1,3-diazinan-1-yl]propanamide
PubChem CID44574447
Molecular FormulaC19H22N4O4
Molecular Weight370.41 g/mol
Exact Mass370.16
IUPAC NameN-hydroxy-2-[2-oxo-3-[4-(pyridin-2-ylmethoxy)phenyl]-1,3-diazinan-1-yl]propanamide
SMILESCC(C(=O)NO)N1CCCN(c2ccc(OCc3ccccn3)cc2)C1=O
InChIInChI=1S/C19H22N4O4/c1-14(18(24)21-26)22-11-4-12-23(19(22)25)16-6-8-17(9-7-16)27-13-15-5-2-3-10-20-15/h2-3,5-10,14,26H,4,11-13H2,1H3,(H,21,24)
InChIKeyCXGYASCJPNLMRT-UHFFFAOYSA-N
XLogP2.19
TPSA95.00 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-hydroxy-2-[3-[4-(naphthalen-1-ylmethoxy)phenyl]-2-oxo-1,3-diazinan-1-yl]propanamide
CID 44574495
(2S)-4-methyl-2-(propan-2-ylamino)-1-[4-(pyridin-2-ylmethoxy)phenyl]pentan-3-one
CID 59915344
methyl 2-[4-(pyridin-2-ylmethoxy)phenyl]acetate
CID 23549386
methyl 1-[4-(pyridin-2-ylmethoxy)phenyl]cyclopropane-1-carboxylate
CID 169171763
[(3S)-3-(methylamino)piperidin-1-yl]-[4-(pyridin-2-ylmethoxy)phenyl]methanone
CID 124575554
4-[(1-methylcyclobutyl)-[4-(pyridin-2-ylmethoxy)phenyl]methyl]benzoic acid
CID 141138739
N-[2-(methylamino)propyl]-4-(pyridin-2-ylmethoxy)benzamide
CID 120828245
(1R)-1-[4-(pyridin-2-ylmethoxy)phenyl]ethanamine
CID 30121102
2-[[4-(1,2,4-triazol-4-yl)phenoxy]methyl]pyridine
CID 50959322
(3R)-1-(4-ethoxyphenyl)-5-oxo-N-[3-(pyridin-2-ylmethoxy)phenyl]pyrrolidine-3-carboxamide
CID 38668542
[1-(2-methylpropylamino)-1-oxopropan-2-yl] (E)-3-[4-(pyridin-2-ylmethoxy)phenyl]prop-2-enoate
CID 55737662
N-methyl-1-[[4-(pyridin-2-ylmethoxy)phenyl]methyl]pyrrolidine-2-carboxamide
CID 86860831

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-[2-oxo-3-[4-(pyridin-2-ylmethoxy)phenyl]-1,3-diazinan-1-yl]propanamide?
The IUPAC name of N-hydroxy-2-[2-oxo-3-[4-(pyridin-2-ylmethoxy)phenyl]-1,3-diazinan-1-yl]propanamide (CID 44574447) is N-hydroxy-2-[2-oxo-3-[4-(pyridin-2-ylmethoxy)phenyl]-1,3-diazinan-1-yl]propanamide.
What is the SMILES notation for N-hydroxy-2-[2-oxo-3-[4-(pyridin-2-ylmethoxy)phenyl]-1,3-diazinan-1-yl]propanamide?
The canonical SMILES for N-hydroxy-2-[2-oxo-3-[4-(pyridin-2-ylmethoxy)phenyl]-1,3-diazinan-1-yl]propanamide is CC(C(=O)NO)N1CCCN(c2ccc(OCc3ccccn3)cc2)C1=O.
What is the InChIKey of N-hydroxy-2-[2-oxo-3-[4-(pyridin-2-ylmethoxy)phenyl]-1,3-diazinan-1-yl]propanamide?
The InChIKey is CXGYASCJPNLMRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O4/c1-14(18(24)21-26)22-11-4-12-23(19(22)25)16-6-8-17(9-7-16)27-13-15-5-2-3-10-20-15/h2-3,5-10,14,26H,4,11-13H2,1H3,(H,21,24).
What are the key properties of N-hydroxy-2-[2-oxo-3-[4-(pyridin-2-ylmethoxy)phenyl]-1,3-diazinan-1-yl]propanamide?
N-hydroxy-2-[2-oxo-3-[4-(pyridin-2-ylmethoxy)phenyl]-1,3-diazinan-1-yl]propanamide has a molecular weight of 370.41 g/mol, XLogP of 2.19, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-[2-oxo-3-[4-(pyridin-2-ylmethoxy)phenyl]-1,3-diazinan-1-yl]propanamide is sourced from PubChem (CID 44574447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).