2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)morpholine

C19H27N5O — CID 133460489

IUPAC2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)morpholine
SMILESCc1cc(C)n(CC2CN(c3nc(C)nc4c3CCCC4)CCO2)n1
InChIInChI=1S/C19H27N5O/c1-13-10-14(2)24(22-13)12-16-11-23(8-9-25-16)19-17-6-4-5-7-18(17)20-15(3)21-19/h10,16H,4-9,11-12H2,1-3H3
InChIKeyDPRUQBPXXWJYBY-UHFFFAOYSA-N
MW341.46 g/mol
LogP2.38
Rot. Bonds3

About 2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)morpholine

2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)morpholine (PubChem CID 133460489) has the molecular formula C19H27N5O and a molecular weight of 341.46 g/mol. Its IUPAC name is 2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)morpholine.

Molecular Properties

Compound Name2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)morpholine
PubChem CID133460489
Molecular FormulaC19H27N5O
Molecular Weight341.46 g/mol
Exact Mass341.22
IUPAC Name2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)morpholine
SMILESCc1cc(C)n(CC2CN(c3nc(C)nc4c3CCCC4)CCO2)n1
InChIInChI=1S/C19H27N5O/c1-13-10-14(2)24(22-13)12-16-11-23(8-9-25-16)19-17-6-4-5-7-18(17)20-15(3)21-19/h10,16H,4-9,11-12H2,1-3H3
InChIKeyDPRUQBPXXWJYBY-UHFFFAOYSA-N
XLogP2.38
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.46
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)morpholine with MolForge

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Related Compounds

(2R)-4-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-2-[(3,5-dimethylpyrazol-1-yl)methyl]morpholine
CID 95274101
(2R)-2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(4-methoxypyrimidin-2-yl)morpholine
CID 95273980
4-[6-[4-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 133461049
4-[3-[(3,5-dimethyl-1,2,4-triazol-1-yl)methyl]piperidin-1-yl]-2-methyl-5,6,7,8-tetrahydroquinazoline
CID 133460481
(2S)-4-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-2-[(3,5-dimethylpyrazol-1-yl)methyl]morpholine
CID 95276284
1-[2-[(3,5-dimethylpyrazol-1-yl)methyl]morpholin-4-yl]-2-(methylamino)ethanone;hydrochloride
CID 120704456
1-(azetidin-1-yl)-2-[(2S)-2-[(3,5-dimethylpyrazol-1-yl)methyl]morpholin-4-yl]ethanone
CID 95274182
2-methyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline;propane
CID 143604667
4-[2-[(3,5-dimethylpyrazol-1-yl)methyl]morpholin-4-yl]pyridine-3-carboxamide
CID 133443391
(2R)-4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-[(3,5-dimethylpyrazol-1-yl)methyl]morpholine
CID 95304496
(2S)-2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-[(1-methylimidazol-2-yl)methyl]morpholine
CID 95274014
4-[2-(2-methoxyethyl)morpholin-4-yl]-5,6,7,8-tetrahydroquinazolin-2-amine
CID 155955250

Frequently Asked Questions

What is the IUPAC name of 2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)morpholine?
The IUPAC name of 2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)morpholine (CID 133460489) is 2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)morpholine.
What is the SMILES notation for 2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)morpholine?
The canonical SMILES for 2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)morpholine is Cc1cc(C)n(CC2CN(c3nc(C)nc4c3CCCC4)CCO2)n1.
What is the InChIKey of 2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)morpholine?
The InChIKey is DPRUQBPXXWJYBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O/c1-13-10-14(2)24(22-13)12-16-11-23(8-9-25-16)19-17-6-4-5-7-18(17)20-15(3)21-19/h10,16H,4-9,11-12H2,1-3H3.
What are the key properties of 2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)morpholine?
2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)morpholine has a molecular weight of 341.46 g/mol, XLogP of 2.38, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)morpholine is sourced from PubChem (CID 133460489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).