(2R)-2-(1-ethoxypropan-2-ylamino)-N-methylpropanamide

C9H20N2O2 — CID 103931984

IUPAC(2R)-2-(1-ethoxypropan-2-ylamino)-N-methylpropanamide
SMILESCCOCC(C)N[C@H](C)C(=O)NC
InChIInChI=1S/C9H20N2O2/c1-5-13-6-7(2)11-8(3)9(12)10-4/h7-8,11H,5-6H2,1-4H3,(H,10,12)/t7?,8-/m1/s1
InChIKeyYOYKZETUIIHGOR-BRFYHDHCSA-N
MW188.27 g/mol
LogP0.14
Rot. Bonds6

About (2R)-2-(1-ethoxypropan-2-ylamino)-N-methylpropanamide

(2R)-2-(1-ethoxypropan-2-ylamino)-N-methylpropanamide (PubChem CID 103931984) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is (2R)-2-(1-ethoxypropan-2-ylamino)-N-methylpropanamide.

Molecular Properties

Compound Name(2R)-2-(1-ethoxypropan-2-ylamino)-N-methylpropanamide
PubChem CID103931984
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC Name(2R)-2-(1-ethoxypropan-2-ylamino)-N-methylpropanamide
SMILESCCOCC(C)N[C@H](C)C(=O)NC
InChIInChI=1S/C9H20N2O2/c1-5-13-6-7(2)11-8(3)9(12)10-4/h7-8,11H,5-6H2,1-4H3,(H,10,12)/t7?,8-/m1/s1
InChIKeyYOYKZETUIIHGOR-BRFYHDHCSA-N
XLogP0.14
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(1-ethoxypropan-2-ylamino)-N-methylpropanamide?
The IUPAC name of (2R)-2-(1-ethoxypropan-2-ylamino)-N-methylpropanamide (CID 103931984) is (2R)-2-(1-ethoxypropan-2-ylamino)-N-methylpropanamide.
What is the SMILES notation for (2R)-2-(1-ethoxypropan-2-ylamino)-N-methylpropanamide?
The canonical SMILES for (2R)-2-(1-ethoxypropan-2-ylamino)-N-methylpropanamide is CCOCC(C)N[C@H](C)C(=O)NC.
What is the InChIKey of (2R)-2-(1-ethoxypropan-2-ylamino)-N-methylpropanamide?
The InChIKey is YOYKZETUIIHGOR-BRFYHDHCSA-N. The full InChI is InChI=1S/C9H20N2O2/c1-5-13-6-7(2)11-8(3)9(12)10-4/h7-8,11H,5-6H2,1-4H3,(H,10,12)/t7?,8-/m1/s1.
What are the key properties of (2R)-2-(1-ethoxypropan-2-ylamino)-N-methylpropanamide?
(2R)-2-(1-ethoxypropan-2-ylamino)-N-methylpropanamide has a molecular weight of 188.27 g/mol, XLogP of 0.14, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(1-ethoxypropan-2-ylamino)-N-methylpropanamide is sourced from PubChem (CID 103931984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).