2-cyclopropyloxy-N-[cyclopropyl(pyridin-2-yl)methyl]benzamide

C19H20N2O2 — CID 138051363

IUPAC2-cyclopropyloxy-N-[cyclopropyl(pyridin-2-yl)methyl]benzamide
SMILESO=C(NC(c1ccccn1)C1CC1)c1ccccc1OC1CC1
InChIInChI=1S/C19H20N2O2/c22-19(15-5-1-2-7-17(15)23-14-10-11-14)21-18(13-8-9-13)16-6-3-4-12-20-16/h1-7,12-14,18H,8-11H2,(H,21,22)
InChIKeyVSOCXCGNCWVELZ-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.50
Rot. Bonds6

About 2-cyclopropyloxy-N-[cyclopropyl(pyridin-2-yl)methyl]benzamide

2-cyclopropyloxy-N-[cyclopropyl(pyridin-2-yl)methyl]benzamide (PubChem CID 138051363) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is 2-cyclopropyloxy-N-[cyclopropyl(pyridin-2-yl)methyl]benzamide.

Molecular Properties

Compound Name2-cyclopropyloxy-N-[cyclopropyl(pyridin-2-yl)methyl]benzamide
PubChem CID138051363
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name2-cyclopropyloxy-N-[cyclopropyl(pyridin-2-yl)methyl]benzamide
SMILESO=C(NC(c1ccccn1)C1CC1)c1ccccc1OC1CC1
InChIInChI=1S/C19H20N2O2/c22-19(15-5-1-2-7-17(15)23-14-10-11-14)21-18(13-8-9-13)16-6-3-4-12-20-16/h1-7,12-14,18H,8-11H2,(H,21,22)
InChIKeyVSOCXCGNCWVELZ-UHFFFAOYSA-N
XLogP3.50
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyloxy-N-[cyclopropyl(pyridin-2-yl)methyl]benzamide?
The IUPAC name of 2-cyclopropyloxy-N-[cyclopropyl(pyridin-2-yl)methyl]benzamide (CID 138051363) is 2-cyclopropyloxy-N-[cyclopropyl(pyridin-2-yl)methyl]benzamide.
What is the SMILES notation for 2-cyclopropyloxy-N-[cyclopropyl(pyridin-2-yl)methyl]benzamide?
The canonical SMILES for 2-cyclopropyloxy-N-[cyclopropyl(pyridin-2-yl)methyl]benzamide is O=C(NC(c1ccccn1)C1CC1)c1ccccc1OC1CC1.
What is the InChIKey of 2-cyclopropyloxy-N-[cyclopropyl(pyridin-2-yl)methyl]benzamide?
The InChIKey is VSOCXCGNCWVELZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c22-19(15-5-1-2-7-17(15)23-14-10-11-14)21-18(13-8-9-13)16-6-3-4-12-20-16/h1-7,12-14,18H,8-11H2,(H,21,22).
What are the key properties of 2-cyclopropyloxy-N-[cyclopropyl(pyridin-2-yl)methyl]benzamide?
2-cyclopropyloxy-N-[cyclopropyl(pyridin-2-yl)methyl]benzamide has a molecular weight of 308.38 g/mol, XLogP of 3.50, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyloxy-N-[cyclopropyl(pyridin-2-yl)methyl]benzamide is sourced from PubChem (CID 138051363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).