N,N-dimethyl-2-[4-[(1-methylpyrazol-3-yl)amino]quinazolin-6-yl]oxypyridine-3-carboxamide

C20H19N7O2 — CID 45483589

IUPACN,N-dimethyl-2-[4-[(1-methylpyrazol-3-yl)amino]quinazolin-6-yl]oxypyridine-3-carboxamide
SMILESCN(C)C(=O)c1cccnc1Oc1ccc2ncnc(Nc3ccn(C)n3)c2c1
InChIInChI=1S/C20H19N7O2/c1-26(2)20(28)14-5-4-9-21-19(14)29-13-6-7-16-15(11-13)18(23-12-22-16)24-17-8-10-27(3)25-17/h4-12H,1-3H3,(H,22,23,24,25)
InChIKeyMFZMDRCHHCCOMV-UHFFFAOYSA-N
MW389.42 g/mol
LogP3.00
Rot. Bonds5

About N,N-dimethyl-2-[4-[(1-methylpyrazol-3-yl)amino]quinazolin-6-yl]oxypyridine-3-carboxamide

N,N-dimethyl-2-[4-[(1-methylpyrazol-3-yl)amino]quinazolin-6-yl]oxypyridine-3-carboxamide (PubChem CID 45483589) has the molecular formula C20H19N7O2 and a molecular weight of 389.42 g/mol. Its IUPAC name is N,N-dimethyl-2-[4-[(1-methylpyrazol-3-yl)amino]quinazolin-6-yl]oxypyridine-3-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[4-[(1-methylpyrazol-3-yl)amino]quinazolin-6-yl]oxypyridine-3-carboxamide
PubChem CID45483589
Molecular FormulaC20H19N7O2
Molecular Weight389.42 g/mol
Exact Mass389.16
IUPAC NameN,N-dimethyl-2-[4-[(1-methylpyrazol-3-yl)amino]quinazolin-6-yl]oxypyridine-3-carboxamide
SMILESCN(C)C(=O)c1cccnc1Oc1ccc2ncnc(Nc3ccn(C)n3)c2c1
InChIInChI=1S/C20H19N7O2/c1-26(2)20(28)14-5-4-9-21-19(14)29-13-6-7-16-15(11-13)18(23-12-22-16)24-17-8-10-27(3)25-17/h4-12H,1-3H3,(H,22,23,24,25)
InChIKeyMFZMDRCHHCCOMV-UHFFFAOYSA-N
XLogP3.00
TPSA98.06 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.42
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

6-(2,4-difluorophenoxy)-N-(1-methyl-1H-pyrazol-3-yl)quinazolin-4-amine
CID 11610032
(2-(4-(1-methyl-1H-pyrazol-3-ylamino)quinazolin-6-yloxy)pyridin-3-yl)methanol
CID 23160263
6-(2,6-Difluorophenoxy)-N-(1-methyl-pyrazol-3-yl)-quinazolin-4-yl-amine
CID 23160266
6-(3-fluoropyridin-2-yloxy)-N-(1-methyl-1H-pyrazol-3-yl)quinazolin-4-amine
CID 23160287
N-(1-methyl-1H-pyrazol-3-yl)-6-(pyridin-2-yloxy)quinazolin-4-amine
CID 45483594
6-pyrazol-1-yl-N-[4-[[3-[5-(trifluoromethyl)pyridin-2-yl]oxyphenyl]methylidene]cyclohexyl]pyridine-3-carboxamide
CID 89463802
2-[4-(1H-indazol-5-yloxy)piperidin-1-yl]-3-methyl-6,7-dihydropyrrolo[3,4-b]pyridin-5-one
CID 129277684
2-[(3S,4R)-3-fluoro-4-(1-methylindazol-5-yl)oxypiperidin-1-yl]-3-methyl-6,7-dihydropyrrolo[3,4-b]pyridin-5-one
CID 129277689
US11299488, Example 23
CID 153496212
2-ethoxy-N-(4-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)phenyl)nicotinamide
CID 7217846
6-(3-bromopyridin-2-yloxy)-N-(1-methyl-1H-pyrazol-3-yl)quinazolin-4-amine
CID 45483579
2-[[2-[4-(1,2,4-Triazol-1-yl)phenoxy]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide
CID 57403027

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[4-[(1-methylpyrazol-3-yl)amino]quinazolin-6-yl]oxypyridine-3-carboxamide?
The IUPAC name of N,N-dimethyl-2-[4-[(1-methylpyrazol-3-yl)amino]quinazolin-6-yl]oxypyridine-3-carboxamide (CID 45483589) is N,N-dimethyl-2-[4-[(1-methylpyrazol-3-yl)amino]quinazolin-6-yl]oxypyridine-3-carboxamide.
What is the SMILES notation for N,N-dimethyl-2-[4-[(1-methylpyrazol-3-yl)amino]quinazolin-6-yl]oxypyridine-3-carboxamide?
The canonical SMILES for N,N-dimethyl-2-[4-[(1-methylpyrazol-3-yl)amino]quinazolin-6-yl]oxypyridine-3-carboxamide is CN(C)C(=O)c1cccnc1Oc1ccc2ncnc(Nc3ccn(C)n3)c2c1.
What is the InChIKey of N,N-dimethyl-2-[4-[(1-methylpyrazol-3-yl)amino]quinazolin-6-yl]oxypyridine-3-carboxamide?
The InChIKey is MFZMDRCHHCCOMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N7O2/c1-26(2)20(28)14-5-4-9-21-19(14)29-13-6-7-16-15(11-13)18(23-12-22-16)24-17-8-10-27(3)25-17/h4-12H,1-3H3,(H,22,23,24,25).
What are the key properties of N,N-dimethyl-2-[4-[(1-methylpyrazol-3-yl)amino]quinazolin-6-yl]oxypyridine-3-carboxamide?
N,N-dimethyl-2-[4-[(1-methylpyrazol-3-yl)amino]quinazolin-6-yl]oxypyridine-3-carboxamide has a molecular weight of 389.42 g/mol, XLogP of 3.00, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[4-[(1-methylpyrazol-3-yl)amino]quinazolin-6-yl]oxypyridine-3-carboxamide is sourced from PubChem (CID 45483589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).