N-hydroxy-4-[6-(6-methoxy-3-pyridinyl)-4-methylquinazolin-8-yl]oxybutanamide

C19H20N4O4 — CID 155561330

IUPACN-hydroxy-4-[6-(6-methoxy-3-pyridinyl)-4-methylquinazolin-8-yl]oxybutanamide
SMILESCOc1ccc(-c2cc(OCCCC(=O)NO)c3ncnc(C)c3c2)cn1
InChIInChI=1S/C19H20N4O4/c1-12-15-8-14(13-5-6-18(26-2)20-10-13)9-16(19(15)22-11-21-12)27-7-3-4-17(24)23-25/h5-6,8-11,25H,3-4,7H2,1-2H3,(H,23,24)
InChIKeyLROLEVRTIPTNKW-UHFFFAOYSA-N
MW368.39 g/mol
LogP2.67
Rot. Bonds7

About N-hydroxy-4-[6-(6-methoxy-3-pyridinyl)-4-methylquinazolin-8-yl]oxybutanamide

N-hydroxy-4-[6-(6-methoxy-3-pyridinyl)-4-methylquinazolin-8-yl]oxybutanamide (PubChem CID 155561330) has the molecular formula C19H20N4O4 and a molecular weight of 368.39 g/mol. Its IUPAC name is N-hydroxy-4-[6-(6-methoxy-3-pyridinyl)-4-methylquinazolin-8-yl]oxybutanamide.

Molecular Properties

Compound NameN-hydroxy-4-[6-(6-methoxy-3-pyridinyl)-4-methylquinazolin-8-yl]oxybutanamide
PubChem CID155561330
Molecular FormulaC19H20N4O4
Molecular Weight368.39 g/mol
Exact Mass368.15
IUPAC NameN-hydroxy-4-[6-(6-methoxy-3-pyridinyl)-4-methylquinazolin-8-yl]oxybutanamide
SMILESCOc1ccc(-c2cc(OCCCC(=O)NO)c3ncnc(C)c3c2)cn1
InChIInChI=1S/C19H20N4O4/c1-12-15-8-14(13-5-6-18(26-2)20-10-13)9-16(19(15)22-11-21-12)27-7-3-4-17(24)23-25/h5-6,8-11,25H,3-4,7H2,1-2H3,(H,23,24)
InChIKeyLROLEVRTIPTNKW-UHFFFAOYSA-N
XLogP2.67
TPSA106.46 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.39
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

Cp-724714
CID 9874913
(E)-2-methoxy-N-(3-(4-(3-methyl-4-(6-methylpyridin-3-yloxy)phenylamino)quinazolin-6-yl)allyl)acetamide
CID 53401057
N-[5-(2-amino-4-methyl-8-propan-2-yloxyquinazolin-6-yl)-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide
CID 135197693
7-[6-[5-[(2,4-difluorophenyl)sulfonylamino]-6-methoxy-3-pyridinyl]-4-methylquinazolin-8-yl]oxy-N-hydroxyheptanamide
CID 155511261
5-[6-[5-[(2,4-difluorophenyl)sulfonylamino]-6-methoxy-3-pyridinyl]-4-methylquinazolin-8-yl]oxy-N-hydroxypentanamide
CID 155517457
9-[6-[5-[(2,4-difluorophenyl)sulfonylamino]-6-methoxy-3-pyridinyl]-4-methylquinazolin-8-yl]oxy-N-hydroxynonanamide
CID 155531296
6-[6-[5-[(2,4-difluorophenyl)sulfonylamino]-6-methoxy-3-pyridinyl]-4-methylquinazolin-8-yl]oxy-N-hydroxyhexanamide
CID 155544267
8-[6-[5-[(2,4-difluorophenyl)sulfonylamino]-6-methoxy-3-pyridinyl]-4-methylquinazolin-8-yl]oxy-N-hydroxyoctanamide
CID 155561726
5-[(4,8-Dimethoxy-2-methylquinolin-6-yl)methyl]pyrimidine-2,4-diamine
CID 14570338
5-[[4-(Dimethylamino)-8-methoxy-2-methylquinolin-6-yl]methyl]pyrimidine-2,4-diamine
CID 14570339
5-[(8-Methoxy-4-methylquinolin-6-yl)methyl]pyrimidine-2,4-diamine
CID 23323035
5-[(8-Methoxyquinolin-6-yl)methyl]pyrimidine-2,4-diamine
CID 23323057

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4-[6-(6-methoxy-3-pyridinyl)-4-methylquinazolin-8-yl]oxybutanamide?
The IUPAC name of N-hydroxy-4-[6-(6-methoxy-3-pyridinyl)-4-methylquinazolin-8-yl]oxybutanamide (CID 155561330) is N-hydroxy-4-[6-(6-methoxy-3-pyridinyl)-4-methylquinazolin-8-yl]oxybutanamide.
What is the SMILES notation for N-hydroxy-4-[6-(6-methoxy-3-pyridinyl)-4-methylquinazolin-8-yl]oxybutanamide?
The canonical SMILES for N-hydroxy-4-[6-(6-methoxy-3-pyridinyl)-4-methylquinazolin-8-yl]oxybutanamide is COc1ccc(-c2cc(OCCCC(=O)NO)c3ncnc(C)c3c2)cn1.
What is the InChIKey of N-hydroxy-4-[6-(6-methoxy-3-pyridinyl)-4-methylquinazolin-8-yl]oxybutanamide?
The InChIKey is LROLEVRTIPTNKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O4/c1-12-15-8-14(13-5-6-18(26-2)20-10-13)9-16(19(15)22-11-21-12)27-7-3-4-17(24)23-25/h5-6,8-11,25H,3-4,7H2,1-2H3,(H,23,24).
What are the key properties of N-hydroxy-4-[6-(6-methoxy-3-pyridinyl)-4-methylquinazolin-8-yl]oxybutanamide?
N-hydroxy-4-[6-(6-methoxy-3-pyridinyl)-4-methylquinazolin-8-yl]oxybutanamide has a molecular weight of 368.39 g/mol, XLogP of 2.67, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-[6-(6-methoxy-3-pyridinyl)-4-methylquinazolin-8-yl]oxybutanamide is sourced from PubChem (CID 155561330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).