3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]butanamide

C16H26N2O3 — CID 51283060

IUPAC3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]butanamide
SMILESCc1ccc(C(CNC(=O)CC(C)C)N2CCOCC2)o1
InChIInChI=1S/C16H26N2O3/c1-12(2)10-16(19)17-11-14(15-5-4-13(3)21-15)18-6-8-20-9-7-18/h4-5,12,14H,6-11H2,1-3H3,(H,17,19)
InChIKeyICWDZYUINWKKEF-UHFFFAOYSA-N
MW294.39 g/mol
LogP2.12
Rot. Bonds6

About 3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]butanamide

3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]butanamide (PubChem CID 51283060) has the molecular formula C16H26N2O3 and a molecular weight of 294.39 g/mol. Its IUPAC name is 3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]butanamide.

Molecular Properties

Compound Name3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]butanamide
PubChem CID51283060
Molecular FormulaC16H26N2O3
Molecular Weight294.39 g/mol
Exact Mass294.19
IUPAC Name3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]butanamide
SMILESCc1ccc(C(CNC(=O)CC(C)C)N2CCOCC2)o1
InChIInChI=1S/C16H26N2O3/c1-12(2)10-16(19)17-11-14(15-5-4-13(3)21-15)18-6-8-20-9-7-18/h4-5,12,14H,6-11H2,1-3H3,(H,17,19)
InChIKeyICWDZYUINWKKEF-UHFFFAOYSA-N
XLogP2.12
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.39
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide
CID 119837790
2-(methylamino)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide
CID 120703417
2-(cyclopropylmethylamino)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide;dihydrochloride
CID 119837781
N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-phenylsulfanylacetamide
CID 134039005
N-[(2S)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
CID 125170167
3-(methanesulfonamido)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]propanamide
CID 118763137
N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-oxo-4-phenylbutanamide
CID 51283099
2-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]propan-1-amine
CID 120509320
N-[2-[[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]amino]-2-oxoethyl]cyclopentanecarboxamide
CID 55649335
2-(4-fluorophenoxy)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]acetamide
CID 18164114
N-[(2S)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-pyrazol-1-ylacetamide
CID 94177106
N-[(2S)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-1-propan-2-ylpiperidine-4-carboxamide
CID 97196259

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]butanamide?
The IUPAC name of 3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]butanamide (CID 51283060) is 3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]butanamide.
What is the SMILES notation for 3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]butanamide?
The canonical SMILES for 3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]butanamide is Cc1ccc(C(CNC(=O)CC(C)C)N2CCOCC2)o1.
What is the InChIKey of 3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]butanamide?
The InChIKey is ICWDZYUINWKKEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O3/c1-12(2)10-16(19)17-11-14(15-5-4-13(3)21-15)18-6-8-20-9-7-18/h4-5,12,14H,6-11H2,1-3H3,(H,17,19).
What are the key properties of 3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]butanamide?
3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]butanamide has a molecular weight of 294.39 g/mol, XLogP of 2.12, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]butanamide is sourced from PubChem (CID 51283060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).