N,2,2-trimethyl-3-morpholin-4-yl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]propan-1-amine

C15H27N3O2 — CID 99929096

IUPACN,2,2-trimethyl-3-morpholin-4-yl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]propan-1-amine
SMILESC[C@@H](c1ccon1)N(C)CC(C)(C)CN1CCOCC1
InChIInChI=1S/C15H27N3O2/c1-13(14-5-8-20-16-14)17(4)11-15(2,3)12-18-6-9-19-10-7-18/h5,8,13H,6-7,9-12H2,1-4H3/t13-/m0/s1
InChIKeyAMYJPDQAQBMCAX-ZDUSSCGKSA-N
MW281.40 g/mol
LogP2.03
Rot. Bonds6

About N,2,2-trimethyl-3-morpholin-4-yl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]propan-1-amine

N,2,2-trimethyl-3-morpholin-4-yl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]propan-1-amine (PubChem CID 99929096) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is N,2,2-trimethyl-3-morpholin-4-yl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]propan-1-amine.

Molecular Properties

Compound NameN,2,2-trimethyl-3-morpholin-4-yl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]propan-1-amine
PubChem CID99929096
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC NameN,2,2-trimethyl-3-morpholin-4-yl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]propan-1-amine
SMILESC[C@@H](c1ccon1)N(C)CC(C)(C)CN1CCOCC1
InChIInChI=1S/C15H27N3O2/c1-13(14-5-8-20-16-14)17(4)11-15(2,3)12-18-6-9-19-10-7-18/h5,8,13H,6-7,9-12H2,1-4H3/t13-/m0/s1
InChIKeyAMYJPDQAQBMCAX-ZDUSSCGKSA-N
XLogP2.03
TPSA41.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-3-morpholin-4-yl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]propan-1-amine?
The IUPAC name of N,2,2-trimethyl-3-morpholin-4-yl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]propan-1-amine (CID 99929096) is N,2,2-trimethyl-3-morpholin-4-yl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]propan-1-amine.
What is the SMILES notation for N,2,2-trimethyl-3-morpholin-4-yl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]propan-1-amine?
The canonical SMILES for N,2,2-trimethyl-3-morpholin-4-yl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]propan-1-amine is C[C@@H](c1ccon1)N(C)CC(C)(C)CN1CCOCC1.
What is the InChIKey of N,2,2-trimethyl-3-morpholin-4-yl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]propan-1-amine?
The InChIKey is AMYJPDQAQBMCAX-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-13(14-5-8-20-16-14)17(4)11-15(2,3)12-18-6-9-19-10-7-18/h5,8,13H,6-7,9-12H2,1-4H3/t13-/m0/s1.
What are the key properties of N,2,2-trimethyl-3-morpholin-4-yl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]propan-1-amine?
N,2,2-trimethyl-3-morpholin-4-yl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]propan-1-amine has a molecular weight of 281.40 g/mol, XLogP of 2.03, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-3-morpholin-4-yl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]propan-1-amine is sourced from PubChem (CID 99929096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).