4-amino-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]quinazoline-7-carboxamide

C20H22N6O2 — CID 166243952

IUPAC4-amino-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]quinazoline-7-carboxamide
SMILESCC1CN(c2ccc(NC(=O)c3ccc4c(N)ncnc4c3)cn2)CC(C)O1
InChIInChI=1S/C20H22N6O2/c1-12-9-26(10-13(2)28-12)18-6-4-15(8-22-18)25-20(27)14-3-5-16-17(7-14)23-11-24-19(16)21/h3-8,11-13H,9-10H2,1-2H3,(H,25,27)(H2,21,23,24)
InChIKeyDMSOCWBGECCAHC-UHFFFAOYSA-N
MW378.44 g/mol
LogP2.47
Rot. Bonds3

About 4-amino-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]quinazoline-7-carboxamide

4-amino-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]quinazoline-7-carboxamide (PubChem CID 166243952) has the molecular formula C20H22N6O2 and a molecular weight of 378.44 g/mol. Its IUPAC name is 4-amino-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]quinazoline-7-carboxamide.

Molecular Properties

Compound Name4-amino-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]quinazoline-7-carboxamide
PubChem CID166243952
Molecular FormulaC20H22N6O2
Molecular Weight378.44 g/mol
Exact Mass378.18
IUPAC Name4-amino-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]quinazoline-7-carboxamide
SMILESCC1CN(c2ccc(NC(=O)c3ccc4c(N)ncnc4c3)cn2)CC(C)O1
InChIInChI=1S/C20H22N6O2/c1-12-9-26(10-13(2)28-12)18-6-4-15(8-22-18)25-20(27)14-3-5-16-17(7-14)23-11-24-19(16)21/h3-8,11-13H,9-10H2,1-2H3,(H,25,27)(H2,21,23,24)
InChIKeyDMSOCWBGECCAHC-UHFFFAOYSA-N
XLogP2.47
TPSA106.26 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.44
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]-4-(methylsulfamoyl)benzamide
CID 166181004
N-[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]pyrazine-2-carboxamide
CID 95149576
3-(cyclopropylsulfamoyl)-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]-4-methoxybenzamide
CID 55814556
1-cyclopropyl-N-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]-2,5-dimethylpyrrole-3-carboxamide
CID 94819448
5-cyclopropyl-N-[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]-1H-pyrazole-3-carboxamide
CID 94775965
N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]-3-(prop-2-enylsulfamoyl)benzamide
CID 55814619
6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(2,4-dimethylphenyl)pyridine-3-carboxamide
CID 37317252
6-chloro-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]-2-methylquinoline-3-carboxamide
CID 55786434
N-(4-chloro-3-quinoxalin-2-ylphenyl)-6-(2,6-dimethylmorpholin-4-yl)pyridine-3-carboxamide
CID 59826586
N-[6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]-5-fluoro-1H-indole-2-carboxamide
CID 51965149
N-cyclooctyl-N'-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]oxamide
CID 71889123
6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-propan-2-ylpyridine-3-carboxamide
CID 37319485

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]quinazoline-7-carboxamide?
The IUPAC name of 4-amino-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]quinazoline-7-carboxamide (CID 166243952) is 4-amino-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]quinazoline-7-carboxamide.
What is the SMILES notation for 4-amino-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]quinazoline-7-carboxamide?
The canonical SMILES for 4-amino-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]quinazoline-7-carboxamide is CC1CN(c2ccc(NC(=O)c3ccc4c(N)ncnc4c3)cn2)CC(C)O1.
What is the InChIKey of 4-amino-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]quinazoline-7-carboxamide?
The InChIKey is DMSOCWBGECCAHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N6O2/c1-12-9-26(10-13(2)28-12)18-6-4-15(8-22-18)25-20(27)14-3-5-16-17(7-14)23-11-24-19(16)21/h3-8,11-13H,9-10H2,1-2H3,(H,25,27)(H2,21,23,24).
What are the key properties of 4-amino-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]quinazoline-7-carboxamide?
4-amino-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]quinazoline-7-carboxamide has a molecular weight of 378.44 g/mol, XLogP of 2.47, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]quinazoline-7-carboxamide is sourced from PubChem (CID 166243952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).