(2R)-N-tert-butyl-2-[methyl-[2-[(2R)-oxan-2-yl]oxyethyl]amino]propanamide

C15H30N2O3 — CID 100668822

IUPAC(2R)-N-tert-butyl-2-[methyl-[2-[(2R)-oxan-2-yl]oxyethyl]amino]propanamide
SMILESC[C@H](C(=O)NC(C)(C)C)N(C)CCO[C@@H]1CCCCO1
InChIInChI=1S/C15H30N2O3/c1-12(14(18)16-15(2,3)4)17(5)9-11-20-13-8-6-7-10-19-13/h12-13H,6-11H2,1-5H3,(H,16,18)/t12-,13-/m1/s1
InChIKeyGKNREJQFUSJDDI-CHWSQXEVSA-N
MW286.42 g/mol
LogP1.76
Rot. Bonds6

About (2R)-N-tert-butyl-2-[methyl-[2-[(2R)-oxan-2-yl]oxyethyl]amino]propanamide

(2R)-N-tert-butyl-2-[methyl-[2-[(2R)-oxan-2-yl]oxyethyl]amino]propanamide (PubChem CID 100668822) has the molecular formula C15H30N2O3 and a molecular weight of 286.42 g/mol. Its IUPAC name is (2R)-N-tert-butyl-2-[methyl-[2-[(2R)-oxan-2-yl]oxyethyl]amino]propanamide.

Molecular Properties

Compound Name(2R)-N-tert-butyl-2-[methyl-[2-[(2R)-oxan-2-yl]oxyethyl]amino]propanamide
PubChem CID100668822
Molecular FormulaC15H30N2O3
Molecular Weight286.42 g/mol
Exact Mass286.23
IUPAC Name(2R)-N-tert-butyl-2-[methyl-[2-[(2R)-oxan-2-yl]oxyethyl]amino]propanamide
SMILESC[C@H](C(=O)NC(C)(C)C)N(C)CCO[C@@H]1CCCCO1
InChIInChI=1S/C15H30N2O3/c1-12(14(18)16-15(2,3)4)17(5)9-11-20-13-8-6-7-10-19-13/h12-13H,6-11H2,1-5H3,(H,16,18)/t12-,13-/m1/s1
InChIKeyGKNREJQFUSJDDI-CHWSQXEVSA-N
XLogP1.76
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-hydroxyethyl(methyl)amino]ethanol;2-[methyl-[2-[(2R)-oxan-2-yl]oxyethyl]amino]ethanol
CID 68855298
N,N'-bis(2-aminoethyl)-2-[6-(oxan-2-yloxy)hexyl]propanediamide
CID 59422079
3-[methyl-[2-[(2S)-oxan-2-yl]oxyethyl]amino]propan-1-ol
CID 146469318
methyl 2-[[1-(tert-butylamino)-1-oxopropan-2-yl]-methylamino]acetate
CID 60677092
N-(3-fluoropropyl)-3,3-dimethyl-N-[2-(oxan-2-yloxy)ethyl]butanamide
CID 71025454
methyl (2R)-2-methyl-3-[(2R)-oxan-2-yl]oxypropanoate
CID 92975409
methyl (2S)-2-methyl-3-(oxan-2-yloxy)propanoate
CID 11195022
N',2,2-trimethyl-N'-[2-(oxan-2-yloxy)ethyl]propane-1,3-diamine
CID 79652545
2-[2-(oxan-2-yloxy)ethylsulfanyl]propanoic acid
CID 61369660
N-tert-butyl-2-[(2-chloro-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-[2-(oxan-2-yloxy)ethyl]amino]acetamide
CID 157029730
1-(oxolan-2-yloxy)propan-2-ol
CID 172822303
ethane;2-(oxan-2-yloxy)ethanol
CID 143259213

Frequently Asked Questions

What is the IUPAC name of (2R)-N-tert-butyl-2-[methyl-[2-[(2R)-oxan-2-yl]oxyethyl]amino]propanamide?
The IUPAC name of (2R)-N-tert-butyl-2-[methyl-[2-[(2R)-oxan-2-yl]oxyethyl]amino]propanamide (CID 100668822) is (2R)-N-tert-butyl-2-[methyl-[2-[(2R)-oxan-2-yl]oxyethyl]amino]propanamide.
What is the SMILES notation for (2R)-N-tert-butyl-2-[methyl-[2-[(2R)-oxan-2-yl]oxyethyl]amino]propanamide?
The canonical SMILES for (2R)-N-tert-butyl-2-[methyl-[2-[(2R)-oxan-2-yl]oxyethyl]amino]propanamide is C[C@H](C(=O)NC(C)(C)C)N(C)CCO[C@@H]1CCCCO1.
What is the InChIKey of (2R)-N-tert-butyl-2-[methyl-[2-[(2R)-oxan-2-yl]oxyethyl]amino]propanamide?
The InChIKey is GKNREJQFUSJDDI-CHWSQXEVSA-N. The full InChI is InChI=1S/C15H30N2O3/c1-12(14(18)16-15(2,3)4)17(5)9-11-20-13-8-6-7-10-19-13/h12-13H,6-11H2,1-5H3,(H,16,18)/t12-,13-/m1/s1.
What are the key properties of (2R)-N-tert-butyl-2-[methyl-[2-[(2R)-oxan-2-yl]oxyethyl]amino]propanamide?
(2R)-N-tert-butyl-2-[methyl-[2-[(2R)-oxan-2-yl]oxyethyl]amino]propanamide has a molecular weight of 286.42 g/mol, XLogP of 1.76, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-tert-butyl-2-[methyl-[2-[(2R)-oxan-2-yl]oxyethyl]amino]propanamide is sourced from PubChem (CID 100668822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).