2-[[(1R)-1-cyclopropylethyl]-methylamino]-N-ethylacetamide

C10H20N2O — CID 52533893

IUPAC2-[[(1R)-1-cyclopropylethyl]-methylamino]-N-ethylacetamide
SMILESCCNC(=O)CN(C)[C@H](C)C1CC1
InChIInChI=1S/C10H20N2O/c1-4-11-10(13)7-12(3)8(2)9-5-6-9/h8-9H,4-7H2,1-3H3,(H,11,13)/t8-/m1/s1
InChIKeyIDXFGCQDUAQUOD-MRVPVSSYSA-N
MW184.28 g/mol
LogP0.85
Rot. Bonds5

About 2-[[(1R)-1-cyclopropylethyl]-methylamino]-N-ethylacetamide

2-[[(1R)-1-cyclopropylethyl]-methylamino]-N-ethylacetamide (PubChem CID 52533893) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-[[(1R)-1-cyclopropylethyl]-methylamino]-N-ethylacetamide.

Molecular Properties

Compound Name2-[[(1R)-1-cyclopropylethyl]-methylamino]-N-ethylacetamide
PubChem CID52533893
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name2-[[(1R)-1-cyclopropylethyl]-methylamino]-N-ethylacetamide
SMILESCCNC(=O)CN(C)[C@H](C)C1CC1
InChIInChI=1S/C10H20N2O/c1-4-11-10(13)7-12(3)8(2)9-5-6-9/h8-9H,4-7H2,1-3H3,(H,11,13)/t8-/m1/s1
InChIKeyIDXFGCQDUAQUOD-MRVPVSSYSA-N
XLogP0.85
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[[(1R)-1-cyclopropylethyl]-methylamino]-N-ethylacetamide?
The IUPAC name of 2-[[(1R)-1-cyclopropylethyl]-methylamino]-N-ethylacetamide (CID 52533893) is 2-[[(1R)-1-cyclopropylethyl]-methylamino]-N-ethylacetamide.
What is the SMILES notation for 2-[[(1R)-1-cyclopropylethyl]-methylamino]-N-ethylacetamide?
The canonical SMILES for 2-[[(1R)-1-cyclopropylethyl]-methylamino]-N-ethylacetamide is CCNC(=O)CN(C)[C@H](C)C1CC1.
What is the InChIKey of 2-[[(1R)-1-cyclopropylethyl]-methylamino]-N-ethylacetamide?
The InChIKey is IDXFGCQDUAQUOD-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-4-11-10(13)7-12(3)8(2)9-5-6-9/h8-9H,4-7H2,1-3H3,(H,11,13)/t8-/m1/s1.
What are the key properties of 2-[[(1R)-1-cyclopropylethyl]-methylamino]-N-ethylacetamide?
2-[[(1R)-1-cyclopropylethyl]-methylamino]-N-ethylacetamide has a molecular weight of 184.28 g/mol, XLogP of 0.85, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(1R)-1-cyclopropylethyl]-methylamino]-N-ethylacetamide is sourced from PubChem (CID 52533893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).