2-methyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide

C17H25N3O4 — CID 120930820

IUPAC2-methyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide
SMILESCc1occc1C(=O)NC1CCN(C(=O)[C@H]2NCCO[C@@H]2C)CC1
InChIInChI=1S/C17H25N3O4/c1-11-14(5-9-23-11)16(21)19-13-3-7-20(8-4-13)17(22)15-12(2)24-10-6-18-15/h5,9,12-13,15,18H,3-4,6-8,10H2,1-2H3,(H,19,21)/t12-,15+/m1/s1
InChIKeySMTGOGKPGQLDJP-DOMZBBRYSA-N
MW335.40 g/mol
LogP0.69
Rot. Bonds3

About 2-methyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide

2-methyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide (PubChem CID 120930820) has the molecular formula C17H25N3O4 and a molecular weight of 335.40 g/mol. Its IUPAC name is 2-methyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide
PubChem CID120930820
Molecular FormulaC17H25N3O4
Molecular Weight335.40 g/mol
Exact Mass335.18
IUPAC Name2-methyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide
SMILESCc1occc1C(=O)NC1CCN(C(=O)[C@H]2NCCO[C@@H]2C)CC1
InChIInChI=1S/C17H25N3O4/c1-11-14(5-9-23-11)16(21)19-13-3-7-20(8-4-13)17(22)15-12(2)24-10-6-18-15/h5,9,12-13,15,18H,3-4,6-8,10H2,1-2H3,(H,19,21)/t12-,15+/m1/s1
InChIKeySMTGOGKPGQLDJP-DOMZBBRYSA-N
XLogP0.69
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.40
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-methyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide with MolForge

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Related Compounds

2,5-dimethyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide;hydrochloride
CID 120930813
N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]thiophene-3-carboxamide;hydrochloride
CID 120928066
N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]cyclohexanecarboxamide;hydrochloride
CID 120928753
[4-(3-methylanilino)piperidin-1-yl]-[(2R,3S)-2-methylmorpholin-3-yl]methanone;dihydrochloride
CID 120942286
[4-(3,4-dimethylphenoxy)piperidin-1-yl]-[(2R,3S)-2-methylmorpholin-3-yl]methanone
CID 120926045
(2R,3S)-N-(1-benzoylpiperidin-4-yl)-2-methylmorpholine-3-carboxamide
CID 120920249
[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]-phenylmethanone;hydrochloride
CID 120920722
2-methyl-N-[1-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]piperidin-4-yl]furan-3-carboxamide
CID 95176270
(4-tert-butylpiperidin-1-yl)-[(2R,3S)-2-methylmorpholin-3-yl]methanone;hydrochloride
CID 120929521
[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]-piperidin-1-ylmethanone;hydrochloride
CID 120919129
N-[1-(3-amino-2-methyl-3-phenylpropanoyl)piperidin-4-yl]-2-methylfuran-3-carboxamide;hydrochloride
CID 119771791
2-methyl-N-[1-(3-piperidin-3-ylbutanoyl)piperidin-4-yl]furan-3-carboxamide;hydrochloride
CID 119771793

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide?
The IUPAC name of 2-methyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide (CID 120930820) is 2-methyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide?
The canonical SMILES for 2-methyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide is Cc1occc1C(=O)NC1CCN(C(=O)[C@H]2NCCO[C@@H]2C)CC1.
What is the InChIKey of 2-methyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide?
The InChIKey is SMTGOGKPGQLDJP-DOMZBBRYSA-N. The full InChI is InChI=1S/C17H25N3O4/c1-11-14(5-9-23-11)16(21)19-13-3-7-20(8-4-13)17(22)15-12(2)24-10-6-18-15/h5,9,12-13,15,18H,3-4,6-8,10H2,1-2H3,(H,19,21)/t12-,15+/m1/s1.
What are the key properties of 2-methyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide?
2-methyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide has a molecular weight of 335.40 g/mol, XLogP of 0.69, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[1-[(2R,3S)-2-methylmorpholine-3-carbonyl]piperidin-4-yl]furan-3-carboxamide is sourced from PubChem (CID 120930820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).