N-[2-(2-hydroxyethyl)-4-methylpentyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide

C18H30N2O4 — CID 109398792

IUPACN-[2-(2-hydroxyethyl)-4-methylpentyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
SMILESCc1ccc(C2CN(C(=O)NCC(CCO)CC(C)C)CCO2)o1
InChIInChI=1S/C18H30N2O4/c1-13(2)10-15(6-8-21)11-19-18(22)20-7-9-23-17(12-20)16-5-4-14(3)24-16/h4-5,13,15,17,21H,6-12H2,1-3H3,(H,19,22)
InChIKeyLKWPZKVBSSCCPT-UHFFFAOYSA-N
MW338.45 g/mol
LogP2.72
Rot. Bonds7

About N-[2-(2-hydroxyethyl)-4-methylpentyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide

N-[2-(2-hydroxyethyl)-4-methylpentyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide (PubChem CID 109398792) has the molecular formula C18H30N2O4 and a molecular weight of 338.45 g/mol. Its IUPAC name is N-[2-(2-hydroxyethyl)-4-methylpentyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(2-hydroxyethyl)-4-methylpentyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
PubChem CID109398792
Molecular FormulaC18H30N2O4
Molecular Weight338.45 g/mol
Exact Mass338.22
IUPAC NameN-[2-(2-hydroxyethyl)-4-methylpentyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
SMILESCc1ccc(C2CN(C(=O)NCC(CCO)CC(C)C)CCO2)o1
InChIInChI=1S/C18H30N2O4/c1-13(2)10-15(6-8-21)11-19-18(22)20-7-9-23-17(12-20)16-5-4-14(3)24-16/h4-5,13,15,17,21H,6-12H2,1-3H3,(H,19,22)
InChIKeyLKWPZKVBSSCCPT-UHFFFAOYSA-N
XLogP2.72
TPSA74.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1H-indol-2-ylmethyl)-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
CID 75389166
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
CID 75432430
(2S)-2-(5-methylfuran-2-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)morpholine-4-carboxamide
CID 97242314
(2S)-2-(5-methylfuran-2-yl)-N-[(3-nitrophenyl)methyl]morpholine-4-carboxamide
CID 97071301
(2R)-2-(5-methylfuran-2-yl)-N-[(3-nitrophenyl)methyl]morpholine-4-carboxamide
CID 97071302
(2S)-N-[(1R,2R)-2-methoxycyclohexyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
CID 98874217
N-[2-(dimethylamino)-6-methyl-3-pyridinyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
CID 75389140
2-(5-methylfuran-2-yl)-N-(thian-3-yl)morpholine-4-carboxamide
CID 75389185
2-(2-chlorophenyl)-N-(2-methylpropyl)morpholine-4-carboxamide
CID 110609422
(2R)-2-(5-methylfuran-2-yl)-N-[3-[(R)-methylsulfinyl]phenyl]morpholine-4-carboxamide
CID 97242640
(2S)-N-[(1R)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide
CID 97242801
(2-ethoxy-6-methyl-3-pyridinyl)-[(2S)-2-(5-methylfuran-2-yl)morpholin-4-yl]methanone
CID 100705820

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-hydroxyethyl)-4-methylpentyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide?
The IUPAC name of N-[2-(2-hydroxyethyl)-4-methylpentyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide (CID 109398792) is N-[2-(2-hydroxyethyl)-4-methylpentyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide.
What is the SMILES notation for N-[2-(2-hydroxyethyl)-4-methylpentyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide?
The canonical SMILES for N-[2-(2-hydroxyethyl)-4-methylpentyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide is Cc1ccc(C2CN(C(=O)NCC(CCO)CC(C)C)CCO2)o1.
What is the InChIKey of N-[2-(2-hydroxyethyl)-4-methylpentyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide?
The InChIKey is LKWPZKVBSSCCPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O4/c1-13(2)10-15(6-8-21)11-19-18(22)20-7-9-23-17(12-20)16-5-4-14(3)24-16/h4-5,13,15,17,21H,6-12H2,1-3H3,(H,19,22).
What are the key properties of N-[2-(2-hydroxyethyl)-4-methylpentyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide?
N-[2-(2-hydroxyethyl)-4-methylpentyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide has a molecular weight of 338.45 g/mol, XLogP of 2.72, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-hydroxyethyl)-4-methylpentyl]-2-(5-methylfuran-2-yl)morpholine-4-carboxamide is sourced from PubChem (CID 109398792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).