2-ethoxy-3-(2-methylcyclopropyl)-N-propan-2-ylpropanamide

C12H23NO2 — CID 21366322

IUPAC2-ethoxy-3-(2-methylcyclopropyl)-N-propan-2-ylpropanamide
SMILESCCOC(CC1CC1C)C(=O)NC(C)C
InChIInChI=1S/C12H23NO2/c1-5-15-11(7-10-6-9(10)4)12(14)13-8(2)3/h8-11H,5-7H2,1-4H3,(H,13,14)
InChIKeyVDYWDYKNUJAVAX-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.96
Rot. Bonds6

About 2-ethoxy-3-(2-methylcyclopropyl)-N-propan-2-ylpropanamide

2-ethoxy-3-(2-methylcyclopropyl)-N-propan-2-ylpropanamide (PubChem CID 21366322) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-ethoxy-3-(2-methylcyclopropyl)-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name2-ethoxy-3-(2-methylcyclopropyl)-N-propan-2-ylpropanamide
PubChem CID21366322
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name2-ethoxy-3-(2-methylcyclopropyl)-N-propan-2-ylpropanamide
SMILESCCOC(CC1CC1C)C(=O)NC(C)C
InChIInChI=1S/C12H23NO2/c1-5-15-11(7-10-6-9(10)4)12(14)13-8(2)3/h8-11H,5-7H2,1-4H3,(H,13,14)
InChIKeyVDYWDYKNUJAVAX-UHFFFAOYSA-N
XLogP1.96
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclobutyl-2-ethoxy-N-propan-2-ylpropanamide
CID 21366338
2-[(2-methylcyclopropyl)methyl]-N-propan-2-ylpentanamide
CID 21366377
2-ethoxy-4-methyl-N-propan-2-ylpent-4-enamide
CID 21366326
3-cyclobutyl-N-propan-2-yl-2-prop-2-enoxypropanamide
CID 21366276
2-ethoxy-N-propan-2-ylpropanamide;2-methoxy-N-propan-2-ylbutanamide
CID 169160521
2-hydroxy-3-methyl-N-propan-2-ylpentanamide
CID 59882624
3-methyl-4-(2-methylcyclopropyl)butan-2-one
CID 91382640
2-(3,3-diethoxypropylamino)-N-propan-2-ylpropanamide
CID 113406943
1-methyl-2-(2-methylpropyl)cyclopropane
CID 54305717
1-ethyl-2-methylcyclopropane;2-methylpropane
CID 155747981
2-amino-3-methyl-N-[(2-methylcyclopropyl)methyl]pentanamide
CID 115738399
2-[(2-methylcyclohexyl)methylamino]-N-propan-2-ylpropanamide
CID 55013491

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-3-(2-methylcyclopropyl)-N-propan-2-ylpropanamide?
The IUPAC name of 2-ethoxy-3-(2-methylcyclopropyl)-N-propan-2-ylpropanamide (CID 21366322) is 2-ethoxy-3-(2-methylcyclopropyl)-N-propan-2-ylpropanamide.
What is the SMILES notation for 2-ethoxy-3-(2-methylcyclopropyl)-N-propan-2-ylpropanamide?
The canonical SMILES for 2-ethoxy-3-(2-methylcyclopropyl)-N-propan-2-ylpropanamide is CCOC(CC1CC1C)C(=O)NC(C)C.
What is the InChIKey of 2-ethoxy-3-(2-methylcyclopropyl)-N-propan-2-ylpropanamide?
The InChIKey is VDYWDYKNUJAVAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-5-15-11(7-10-6-9(10)4)12(14)13-8(2)3/h8-11H,5-7H2,1-4H3,(H,13,14).
What are the key properties of 2-ethoxy-3-(2-methylcyclopropyl)-N-propan-2-ylpropanamide?
2-ethoxy-3-(2-methylcyclopropyl)-N-propan-2-ylpropanamide has a molecular weight of 213.32 g/mol, XLogP of 1.96, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-3-(2-methylcyclopropyl)-N-propan-2-ylpropanamide is sourced from PubChem (CID 21366322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).