(2S)-2-(furan-2-yl)-N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]pyrrolidine-1-carboxamide

C18H29N3O3 — CID 124778574

IUPAC(2S)-2-(furan-2-yl)-N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]pyrrolidine-1-carboxamide
SMILESCC(C)CN1CCO[C@@H](CNC(=O)N2CCC[C@H]2c2ccco2)C1
InChIInChI=1S/C18H29N3O3/c1-14(2)12-20-8-10-23-15(13-20)11-19-18(22)21-7-3-5-16(21)17-6-4-9-24-17/h4,6,9,14-16H,3,5,7-8,10-13H2,1-2H3,(H,19,22)/t15-,16-/m0/s1
InChIKeyMVDFXWYZVXZNOV-HOTGVXAUSA-N
MW335.45 g/mol
LogP2.48
Rot. Bonds5

About (2S)-2-(furan-2-yl)-N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]pyrrolidine-1-carboxamide

(2S)-2-(furan-2-yl)-N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]pyrrolidine-1-carboxamide (PubChem CID 124778574) has the molecular formula C18H29N3O3 and a molecular weight of 335.45 g/mol. Its IUPAC name is (2S)-2-(furan-2-yl)-N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound Name(2S)-2-(furan-2-yl)-N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]pyrrolidine-1-carboxamide
PubChem CID124778574
Molecular FormulaC18H29N3O3
Molecular Weight335.45 g/mol
Exact Mass335.22
IUPAC Name(2S)-2-(furan-2-yl)-N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]pyrrolidine-1-carboxamide
SMILESCC(C)CN1CCO[C@@H](CNC(=O)N2CCC[C@H]2c2ccco2)C1
InChIInChI=1S/C18H29N3O3/c1-14(2)12-20-8-10-23-15(13-20)11-19-18(22)21-7-3-5-16(21)17-6-4-9-24-17/h4,6,9,14-16H,3,5,7-8,10-13H2,1-2H3,(H,19,22)/t15-,16-/m0/s1
InChIKeyMVDFXWYZVXZNOV-HOTGVXAUSA-N
XLogP2.48
TPSA57.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.45
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2S)-2-(furan-2-yl)-N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]pyrrolidine-1-carboxamide with MolForge

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Related Compounds

4-(furan-2-carbonyl)-N'-methyl-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]piperazine-1-carboximidamide
CID 111166111
N-[[(2R)-4-(2-methylpropyl)morpholin-2-yl]methyl]-2,2-diphenylacetamide
CID 7995361
2,6-difluoro-N-[[(2R)-4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide
CID 39485652
4-(2-chlorophenyl)-N-[[(2R)-4-(2-methylpropyl)morpholin-2-yl]methyl]piperazine-1-carboxamide
CID 52502865
N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]cyclopropanecarboxamide
CID 95168375
N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 30538422
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2-(furan-2-yl)azepane-1-carboxamide
CID 71930413
(2R)-2-(furan-2-yl)-N-(3-methoxypropyl)pyrrolidine-1-carboxamide
CID 51551008
2-(3-cyclohexyl-2,4,5-trioxoimidazolidin-1-yl)-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]acetamide
CID 55547591
N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]-2,3-dihydro-1-benzothiophene-2-carboxamide
CID 24642400
N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]-2-phenylsulfanylacetamide
CID 78812434
N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]thiophene-2-carboxamide
CID 35362501

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(furan-2-yl)-N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]pyrrolidine-1-carboxamide?
The IUPAC name of (2S)-2-(furan-2-yl)-N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]pyrrolidine-1-carboxamide (CID 124778574) is (2S)-2-(furan-2-yl)-N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for (2S)-2-(furan-2-yl)-N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]pyrrolidine-1-carboxamide?
The canonical SMILES for (2S)-2-(furan-2-yl)-N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]pyrrolidine-1-carboxamide is CC(C)CN1CCO[C@@H](CNC(=O)N2CCC[C@H]2c2ccco2)C1.
What is the InChIKey of (2S)-2-(furan-2-yl)-N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]pyrrolidine-1-carboxamide?
The InChIKey is MVDFXWYZVXZNOV-HOTGVXAUSA-N. The full InChI is InChI=1S/C18H29N3O3/c1-14(2)12-20-8-10-23-15(13-20)11-19-18(22)21-7-3-5-16(21)17-6-4-9-24-17/h4,6,9,14-16H,3,5,7-8,10-13H2,1-2H3,(H,19,22)/t15-,16-/m0/s1.
What are the key properties of (2S)-2-(furan-2-yl)-N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]pyrrolidine-1-carboxamide?
(2S)-2-(furan-2-yl)-N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]pyrrolidine-1-carboxamide has a molecular weight of 335.45 g/mol, XLogP of 2.48, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(furan-2-yl)-N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 124778574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).