N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]butanamide

C11H20N2O3 — CID 110347736

IUPACN-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]butanamide
SMILESCCCC(=O)N[C@@H](C)C(=O)N1CCOCC1
InChIInChI=1S/C11H20N2O3/c1-3-4-10(14)12-9(2)11(15)13-5-7-16-8-6-13/h9H,3-8H2,1-2H3,(H,12,14)/t9-/m0/s1
InChIKeyDDBDDUYGKVSKIN-VIFPVBQESA-N
MW228.29 g/mol
LogP0.15
Rot. Bonds4

About N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]butanamide

N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]butanamide (PubChem CID 110347736) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]butanamide.

Molecular Properties

Compound NameN-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]butanamide
PubChem CID110347736
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC NameN-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]butanamide
SMILESCCCC(=O)N[C@@H](C)C(=O)N1CCOCC1
InChIInChI=1S/C11H20N2O3/c1-3-4-10(14)12-9(2)11(15)13-5-7-16-8-6-13/h9H,3-8H2,1-2H3,(H,12,14)/t9-/m0/s1
InChIKeyDDBDDUYGKVSKIN-VIFPVBQESA-N
XLogP0.15
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(1-morpholin-4-yl-1-oxopropan-2-yl)propanamide
CID 112700894
2-methoxy-N-(1-morpholin-4-yl-1-oxopropan-2-yl)acetamide
CID 112684465
[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid
CID 67759315
1-ethyl-3-(1-morpholin-4-yl-1-oxopropan-2-yl)urea
CID 116657745
1,1-diethyl-3-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]urea
CID 110347785
2-[2-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]-2-oxoethoxy]acetic acid
CID 113408335
1-(1-morpholin-4-yl-1-oxopropan-2-yl)-3-propan-2-ylurea
CID 115620431
N-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidine-1-carboxamide
CID 116657750
2-anilino-N-(1-morpholin-4-yl-1-oxopropan-2-yl)acetamide
CID 115673259
N-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 86863401
2-(3-methylpentan-3-ylamino)-1-morpholin-4-ylpropan-1-one
CID 114174239
N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]cyclopropanecarboxamide
CID 110347737

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]butanamide?
The IUPAC name of N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]butanamide (CID 110347736) is N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]butanamide.
What is the SMILES notation for N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]butanamide?
The canonical SMILES for N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]butanamide is CCCC(=O)N[C@@H](C)C(=O)N1CCOCC1.
What is the InChIKey of N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]butanamide?
The InChIKey is DDBDDUYGKVSKIN-VIFPVBQESA-N. The full InChI is InChI=1S/C11H20N2O3/c1-3-4-10(14)12-9(2)11(15)13-5-7-16-8-6-13/h9H,3-8H2,1-2H3,(H,12,14)/t9-/m0/s1.
What are the key properties of N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]butanamide?
N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]butanamide has a molecular weight of 228.29 g/mol, XLogP of 0.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]butanamide is sourced from PubChem (CID 110347736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).