4-[[4-cyclopropyl-2-(1H-pyrazol-5-yl)quinolin-6-yl]methyl]morpholine

C20H22N4O — CID 170504848

IUPAC4-[[4-cyclopropyl-2-(1H-pyrazol-5-yl)quinolin-6-yl]methyl]morpholine
SMILESc1cc(-c2cc(C3CC3)c3cc(CN4CCOCC4)ccc3n2)[nH]n1
InChIInChI=1S/C20H22N4O/c1-4-18-17(11-14(1)13-24-7-9-25-10-8-24)16(15-2-3-15)12-20(22-18)19-5-6-21-23-19/h1,4-6,11-12,15H,2-3,7-10,13H2,(H,21,23)
InChIKeySTFBWCPHZSIMEI-UHFFFAOYSA-N
MW334.42 g/mol
LogP3.33
Rot. Bonds4

About 4-[[4-cyclopropyl-2-(1H-pyrazol-5-yl)quinolin-6-yl]methyl]morpholine

4-[[4-cyclopropyl-2-(1H-pyrazol-5-yl)quinolin-6-yl]methyl]morpholine (PubChem CID 170504848) has the molecular formula C20H22N4O and a molecular weight of 334.42 g/mol. Its IUPAC name is 4-[[4-cyclopropyl-2-(1H-pyrazol-5-yl)quinolin-6-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[4-cyclopropyl-2-(1H-pyrazol-5-yl)quinolin-6-yl]methyl]morpholine
PubChem CID170504848
Molecular FormulaC20H22N4O
Molecular Weight334.42 g/mol
Exact Mass334.18
IUPAC Name4-[[4-cyclopropyl-2-(1H-pyrazol-5-yl)quinolin-6-yl]methyl]morpholine
SMILESc1cc(-c2cc(C3CC3)c3cc(CN4CCOCC4)ccc3n2)[nH]n1
InChIInChI=1S/C20H22N4O/c1-4-18-17(11-14(1)13-24-7-9-25-10-8-24)16(15-2-3-15)12-20(22-18)19-5-6-21-23-19/h1,4-6,11-12,15H,2-3,7-10,13H2,(H,21,23)
InChIKeySTFBWCPHZSIMEI-UHFFFAOYSA-N
XLogP3.33
TPSA54.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[[4-cyclopropyl-2-(1H-pyrazol-5-yl)quinolin-6-yl]methyl]morpholine with MolForge

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Related Compounds

4-cyclopropyl-6-(methylsulfonylmethyl)-2-(1H-pyrazol-5-yl)quinoline
CID 170513105
4-[[4-methyl-2-(2H-pyrazolo[3,4-b]pyridin-3-yl)quinolin-6-yl]methyl]morpholine
CID 170502682
3-[4-methyl-6-(morpholin-4-ylmethyl)quinolin-2-yl]phenol
CID 169415857
2,3-dimethoxy-6-(morpholin-4-ylmethyl)quinazolin-4-one
CID 66769782
bis[2-cyclopentyl-4-(morpholin-4-ylmethyl)phenyl]methanone
CID 73011711
2-[4-cyclopropyl-2-(2-methylpyrazol-3-yl)quinolin-6-yl]-1-pyrrolidin-1-ylethanone
CID 170511024
4-methyl-6-(1H-pyrazol-5-yl)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]pyrimidin-2-amine
CID 141174303
4-morpholin-4-yl-6-(1H-pyrazol-5-yl)pyrimidin-2-amine
CID 50982860
ethane;4-[(2-methyl-1,3-benzothiazol-6-yl)methyl]morpholine
CID 145100782
4-[[4-[6-fluoro-4-[(4-propylpiperazin-1-yl)methyl]quinolin-2-yl]phenyl]methyl]morpholine
CID 155532654
13-[(1,3,4-triphenylpyrazolo[3,4-b]quinolin-6-yl)methyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane
CID 90756534
2-cyclopropyl-6-(pyrrolidin-1-ylmethyl)quinoline
CID 174283470

Frequently Asked Questions

What is the IUPAC name of 4-[[4-cyclopropyl-2-(1H-pyrazol-5-yl)quinolin-6-yl]methyl]morpholine?
The IUPAC name of 4-[[4-cyclopropyl-2-(1H-pyrazol-5-yl)quinolin-6-yl]methyl]morpholine (CID 170504848) is 4-[[4-cyclopropyl-2-(1H-pyrazol-5-yl)quinolin-6-yl]methyl]morpholine.
What is the SMILES notation for 4-[[4-cyclopropyl-2-(1H-pyrazol-5-yl)quinolin-6-yl]methyl]morpholine?
The canonical SMILES for 4-[[4-cyclopropyl-2-(1H-pyrazol-5-yl)quinolin-6-yl]methyl]morpholine is c1cc(-c2cc(C3CC3)c3cc(CN4CCOCC4)ccc3n2)[nH]n1.
What is the InChIKey of 4-[[4-cyclopropyl-2-(1H-pyrazol-5-yl)quinolin-6-yl]methyl]morpholine?
The InChIKey is STFBWCPHZSIMEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O/c1-4-18-17(11-14(1)13-24-7-9-25-10-8-24)16(15-2-3-15)12-20(22-18)19-5-6-21-23-19/h1,4-6,11-12,15H,2-3,7-10,13H2,(H,21,23).
What are the key properties of 4-[[4-cyclopropyl-2-(1H-pyrazol-5-yl)quinolin-6-yl]methyl]morpholine?
4-[[4-cyclopropyl-2-(1H-pyrazol-5-yl)quinolin-6-yl]methyl]morpholine has a molecular weight of 334.42 g/mol, XLogP of 3.33, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-cyclopropyl-2-(1H-pyrazol-5-yl)quinolin-6-yl]methyl]morpholine is sourced from PubChem (CID 170504848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).