N-methyl-2-morpholin-4-yl-N-[1-(quinoline-3-carbonyl)piperidin-3-yl]acetamide

C22H28N4O3 — CID 138007240

IUPACN-methyl-2-morpholin-4-yl-N-[1-(quinoline-3-carbonyl)piperidin-3-yl]acetamide
SMILESCN(C(=O)CN1CCOCC1)C1CCCN(C(=O)c2cnc3ccccc3c2)C1
InChIInChI=1S/C22H28N4O3/c1-24(21(27)16-25-9-11-29-12-10-25)19-6-4-8-26(15-19)22(28)18-13-17-5-2-3-7-20(17)23-14-18/h2-3,5,7,13-14,19H,4,6,8-12,15-16H2,1H3
InChIKeyRCJIYCOXRRUDKB-UHFFFAOYSA-N
MW396.49 g/mol
LogP1.63
Rot. Bonds4

About N-methyl-2-morpholin-4-yl-N-[1-(quinoline-3-carbonyl)piperidin-3-yl]acetamide

N-methyl-2-morpholin-4-yl-N-[1-(quinoline-3-carbonyl)piperidin-3-yl]acetamide (PubChem CID 138007240) has the molecular formula C22H28N4O3 and a molecular weight of 396.49 g/mol. Its IUPAC name is N-methyl-2-morpholin-4-yl-N-[1-(quinoline-3-carbonyl)piperidin-3-yl]acetamide.

Molecular Properties

Compound NameN-methyl-2-morpholin-4-yl-N-[1-(quinoline-3-carbonyl)piperidin-3-yl]acetamide
PubChem CID138007240
Molecular FormulaC22H28N4O3
Molecular Weight396.49 g/mol
Exact Mass396.22
IUPAC NameN-methyl-2-morpholin-4-yl-N-[1-(quinoline-3-carbonyl)piperidin-3-yl]acetamide
SMILESCN(C(=O)CN1CCOCC1)C1CCCN(C(=O)c2cnc3ccccc3c2)C1
InChIInChI=1S/C22H28N4O3/c1-24(21(27)16-25-9-11-29-12-10-25)19-6-4-8-26(15-19)22(28)18-13-17-5-2-3-7-20(17)23-14-18/h2-3,5,7,13-14,19H,4,6,8-12,15-16H2,1H3
InChIKeyRCJIYCOXRRUDKB-UHFFFAOYSA-N
XLogP1.63
TPSA65.98 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.49
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-methyl-2-morpholin-4-yl-N-[1-(quinoline-3-carbonyl)piperidin-3-yl]acetamide with MolForge

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Related Compounds

[3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-quinolin-3-ylmethanone
CID 70781771
2-[2-[(3S)-1-(quinoline-3-carbonyl)piperidin-3-yl]imidazol-1-yl]acetamide
CID 97269284
(2-methylpyrimidin-5-yl)-[(3R)-3-(quinolin-3-ylmethyl)piperidin-1-yl]methanone
CID 124961648
2-(3-hydroxypiperidin-1-yl)-N-methyl-N-(quinolin-3-ylmethyl)acetamide
CID 91794996
2-[(3S)-3-hydroxypiperidin-1-yl]-N-methyl-N-(quinolin-3-ylmethyl)acetamide
CID 124679861
(7-fluoroquinolin-3-yl)-(3-methylpiperidin-1-yl)methanone
CID 110489762
[(3S,4S)-3-(hydroxymethyl)-4-[[4-(hydroxymethyl)piperidin-1-yl]methyl]pyrrolidin-1-yl]-quinolin-3-ylmethanone
CID 133139281
[2-(4-amino-6-methyl-2-pyridinyl)morpholin-4-yl]-quinolin-3-ylmethanone
CID 110113455
[(1R)-1-quinolin-3-ylethyl] 2-morpholin-4-ylacetate
CID 97308909
[(3R,4R)-3-(hydroxymethyl)-4-(piperidin-1-ylmethyl)pyrrolidin-1-yl]-quinolin-3-ylmethanone
CID 70737092
[(2R)-2-(4-methylpyrimidin-2-yl)morpholin-4-yl]-quinolin-3-ylmethanone
CID 124959536
[3-[2-methyl-6-(5-methyl-1H-imidazol-2-yl)pyrimidin-4-yl]piperidin-1-yl]-quinolin-3-ylmethanone
CID 110110902

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-morpholin-4-yl-N-[1-(quinoline-3-carbonyl)piperidin-3-yl]acetamide?
The IUPAC name of N-methyl-2-morpholin-4-yl-N-[1-(quinoline-3-carbonyl)piperidin-3-yl]acetamide (CID 138007240) is N-methyl-2-morpholin-4-yl-N-[1-(quinoline-3-carbonyl)piperidin-3-yl]acetamide.
What is the SMILES notation for N-methyl-2-morpholin-4-yl-N-[1-(quinoline-3-carbonyl)piperidin-3-yl]acetamide?
The canonical SMILES for N-methyl-2-morpholin-4-yl-N-[1-(quinoline-3-carbonyl)piperidin-3-yl]acetamide is CN(C(=O)CN1CCOCC1)C1CCCN(C(=O)c2cnc3ccccc3c2)C1.
What is the InChIKey of N-methyl-2-morpholin-4-yl-N-[1-(quinoline-3-carbonyl)piperidin-3-yl]acetamide?
The InChIKey is RCJIYCOXRRUDKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N4O3/c1-24(21(27)16-25-9-11-29-12-10-25)19-6-4-8-26(15-19)22(28)18-13-17-5-2-3-7-20(17)23-14-18/h2-3,5,7,13-14,19H,4,6,8-12,15-16H2,1H3.
What are the key properties of N-methyl-2-morpholin-4-yl-N-[1-(quinoline-3-carbonyl)piperidin-3-yl]acetamide?
N-methyl-2-morpholin-4-yl-N-[1-(quinoline-3-carbonyl)piperidin-3-yl]acetamide has a molecular weight of 396.49 g/mol, XLogP of 1.63, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-morpholin-4-yl-N-[1-(quinoline-3-carbonyl)piperidin-3-yl]acetamide is sourced from PubChem (CID 138007240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).