(2R)-2-amino-3-methyl-N-(1-morpholin-4-ylpropan-2-yl)butanamide

C12H25N3O2 — CID 79011788

IUPAC(2R)-2-amino-3-methyl-N-(1-morpholin-4-ylpropan-2-yl)butanamide
SMILESCC(CN1CCOCC1)NC(=O)[C@H](N)C(C)C
InChIInChI=1S/C12H25N3O2/c1-9(2)11(13)12(16)14-10(3)8-15-4-6-17-7-5-15/h9-11H,4-8,13H2,1-3H3,(H,14,16)/t10?,11-/m1/s1
InChIKeyFICUSPHVUQKFEH-RRKGBCIJSA-N
MW243.35 g/mol
LogP-0.19
Rot. Bonds5

About (2R)-2-amino-3-methyl-N-(1-morpholin-4-ylpropan-2-yl)butanamide

(2R)-2-amino-3-methyl-N-(1-morpholin-4-ylpropan-2-yl)butanamide (PubChem CID 79011788) has the molecular formula C12H25N3O2 and a molecular weight of 243.35 g/mol. Its IUPAC name is (2R)-2-amino-3-methyl-N-(1-morpholin-4-ylpropan-2-yl)butanamide.

Molecular Properties

Compound Name(2R)-2-amino-3-methyl-N-(1-morpholin-4-ylpropan-2-yl)butanamide
PubChem CID79011788
Molecular FormulaC12H25N3O2
Molecular Weight243.35 g/mol
Exact Mass243.19
IUPAC Name(2R)-2-amino-3-methyl-N-(1-morpholin-4-ylpropan-2-yl)butanamide
SMILESCC(CN1CCOCC1)NC(=O)[C@H](N)C(C)C
InChIInChI=1S/C12H25N3O2/c1-9(2)11(13)12(16)14-10(3)8-15-4-6-17-7-5-15/h9-11H,4-8,13H2,1-3H3,(H,14,16)/t10?,11-/m1/s1
InChIKeyFICUSPHVUQKFEH-RRKGBCIJSA-N
XLogP-0.19
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-amino-N-(1-morpholin-4-ylpropan-2-yl)propanamide
CID 78972664
(2S)-2-amino-N-(1-morpholin-4-ylpropan-2-yl)pentanamide
CID 107568380
(2R)-2-amino-N-(1-morpholin-4-ylpropan-2-yl)pentanamide
CID 103813602
2-amino-N-(1-morpholin-4-ylpropan-2-yl)-2-phenylacetamide;dihydrochloride
CID 119851564
3-amino-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)-3-phenylpropanamide
CID 119851584
3-amino-N-(1-morpholin-4-ylpropan-2-yl)propanamide;dihydrochloride
CID 119851619
1-(1-morpholin-4-ylpropan-2-yl)-3-(oxan-4-yl)urea
CID 128943207
4-hydroxy-N-(1-morpholin-4-ylpropan-2-yl)butanamide
CID 79201322
4-hydroxy-N-(1-morpholin-4-ylpropan-2-yl)pentanamide
CID 79201323
tert-butyl N-[(2S)-1-morpholin-4-ylpropan-2-yl]carbamate
CID 58441909
(2R)-N-[(2S)-1-morpholin-4-ylpropan-2-yl]-2-pyrazol-1-ylpropanamide
CID 95134476
(2S)-2-amino-3-methyl-N-morpholin-4-ylbutanamide;hydrochloride
CID 57484828

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-3-methyl-N-(1-morpholin-4-ylpropan-2-yl)butanamide?
The IUPAC name of (2R)-2-amino-3-methyl-N-(1-morpholin-4-ylpropan-2-yl)butanamide (CID 79011788) is (2R)-2-amino-3-methyl-N-(1-morpholin-4-ylpropan-2-yl)butanamide.
What is the SMILES notation for (2R)-2-amino-3-methyl-N-(1-morpholin-4-ylpropan-2-yl)butanamide?
The canonical SMILES for (2R)-2-amino-3-methyl-N-(1-morpholin-4-ylpropan-2-yl)butanamide is CC(CN1CCOCC1)NC(=O)[C@H](N)C(C)C.
What is the InChIKey of (2R)-2-amino-3-methyl-N-(1-morpholin-4-ylpropan-2-yl)butanamide?
The InChIKey is FICUSPHVUQKFEH-RRKGBCIJSA-N. The full InChI is InChI=1S/C12H25N3O2/c1-9(2)11(13)12(16)14-10(3)8-15-4-6-17-7-5-15/h9-11H,4-8,13H2,1-3H3,(H,14,16)/t10?,11-/m1/s1.
What are the key properties of (2R)-2-amino-3-methyl-N-(1-morpholin-4-ylpropan-2-yl)butanamide?
(2R)-2-amino-3-methyl-N-(1-morpholin-4-ylpropan-2-yl)butanamide has a molecular weight of 243.35 g/mol, XLogP of -0.19, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-3-methyl-N-(1-morpholin-4-ylpropan-2-yl)butanamide is sourced from PubChem (CID 79011788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).