[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid

C8H14N2O4 — CID 67759315

IUPAC[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid
SMILESC[C@H](NC(=O)O)C(=O)N1CCOCC1
InChIInChI=1S/C8H14N2O4/c1-6(9-8(12)13)7(11)10-2-4-14-5-3-10/h6,9H,2-5H2,1H3,(H,12,13)/t6-/m0/s1
InChIKeyFNUZPULBBAMZEL-LURJTMIESA-N
MW202.21 g/mol
LogP-0.50
Rot. Bonds2

About [(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid

[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid (PubChem CID 67759315) has the molecular formula C8H14N2O4 and a molecular weight of 202.21 g/mol. Its IUPAC name is [(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid.

Molecular Properties

Compound Name[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid
PubChem CID67759315
Molecular FormulaC8H14N2O4
Molecular Weight202.21 g/mol
Exact Mass202.10
IUPAC Name[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid
SMILESC[C@H](NC(=O)O)C(=O)N1CCOCC1
InChIInChI=1S/C8H14N2O4/c1-6(9-8(12)13)7(11)10-2-4-14-5-3-10/h6,9H,2-5H2,1H3,(H,12,13)/t6-/m0/s1
InChIKeyFNUZPULBBAMZEL-LURJTMIESA-N
XLogP-0.50
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 5-0.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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
N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]cyclopropanecarboxamide
CID 110347737
N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]butanamide
CID 110347736
1-ethyl-3-(1-morpholin-4-yl-1-oxopropan-2-yl)urea
CID 116657745
[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]carbamic acid
CID 175945134
1,1-diethyl-3-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]urea
CID 110347785
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
2-amino-2-methyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)propanamide;hydrochloride
CID 119308587
2-[2-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]-2-oxoethoxy]acetic acid
CID 113408335
3-chloro-2,2-dimethyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)propanamide
CID 113408370

Frequently Asked Questions

What is the IUPAC name of [(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid?
The IUPAC name of [(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid (CID 67759315) is [(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid.
What is the SMILES notation for [(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid?
The canonical SMILES for [(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid is C[C@H](NC(=O)O)C(=O)N1CCOCC1.
What is the InChIKey of [(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid?
The InChIKey is FNUZPULBBAMZEL-LURJTMIESA-N. The full InChI is InChI=1S/C8H14N2O4/c1-6(9-8(12)13)7(11)10-2-4-14-5-3-10/h6,9H,2-5H2,1H3,(H,12,13)/t6-/m0/s1.
What are the key properties of [(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid?
[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid has a molecular weight of 202.21 g/mol, XLogP of -0.50, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid is sourced from PubChem (CID 67759315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).