1-cyano-N-ethyl-N-(1-methoxypropan-2-yl)cyclopropane-1-carboxamide

C11H18N2O2 — CID 80599125

IUPAC1-cyano-N-ethyl-N-(1-methoxypropan-2-yl)cyclopropane-1-carboxamide
SMILESCCN(C(=O)C1(C#N)CC1)C(C)COC
InChIInChI=1S/C11H18N2O2/c1-4-13(9(2)7-15-3)10(14)11(8-12)5-6-11/h9H,4-7H2,1-3H3
InChIKeyUVMADEGPEOTXMN-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.17
Rot. Bonds5

About 1-cyano-N-ethyl-N-(1-methoxypropan-2-yl)cyclopropane-1-carboxamide

1-cyano-N-ethyl-N-(1-methoxypropan-2-yl)cyclopropane-1-carboxamide (PubChem CID 80599125) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 1-cyano-N-ethyl-N-(1-methoxypropan-2-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-cyano-N-ethyl-N-(1-methoxypropan-2-yl)cyclopropane-1-carboxamide
PubChem CID80599125
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name1-cyano-N-ethyl-N-(1-methoxypropan-2-yl)cyclopropane-1-carboxamide
SMILESCCN(C(=O)C1(C#N)CC1)C(C)COC
InChIInChI=1S/C11H18N2O2/c1-4-13(9(2)7-15-3)10(14)11(8-12)5-6-11/h9H,4-7H2,1-3H3
InChIKeyUVMADEGPEOTXMN-UHFFFAOYSA-N
XLogP1.17
TPSA53.33 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyano-N-ethyl-N-(1-methoxypropan-2-yl)cyclopropane-1-carboxamide?
The IUPAC name of 1-cyano-N-ethyl-N-(1-methoxypropan-2-yl)cyclopropane-1-carboxamide (CID 80599125) is 1-cyano-N-ethyl-N-(1-methoxypropan-2-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-cyano-N-ethyl-N-(1-methoxypropan-2-yl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-cyano-N-ethyl-N-(1-methoxypropan-2-yl)cyclopropane-1-carboxamide is CCN(C(=O)C1(C#N)CC1)C(C)COC.
What is the InChIKey of 1-cyano-N-ethyl-N-(1-methoxypropan-2-yl)cyclopropane-1-carboxamide?
The InChIKey is UVMADEGPEOTXMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-4-13(9(2)7-15-3)10(14)11(8-12)5-6-11/h9H,4-7H2,1-3H3.
What are the key properties of 1-cyano-N-ethyl-N-(1-methoxypropan-2-yl)cyclopropane-1-carboxamide?
1-cyano-N-ethyl-N-(1-methoxypropan-2-yl)cyclopropane-1-carboxamide has a molecular weight of 210.28 g/mol, XLogP of 1.17, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyano-N-ethyl-N-(1-methoxypropan-2-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 80599125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).