N-cyclopropyl-2-(oxan-4-yl)-N-(pyrrolidin-3-ylmethyl)acetamide

C15H26N2O2 — CID 141152199

IUPACN-cyclopropyl-2-(oxan-4-yl)-N-(pyrrolidin-3-ylmethyl)acetamide
SMILESO=C(CC1CCOCC1)N(CC1CCNC1)C1CC1
InChIInChI=1S/C15H26N2O2/c18-15(9-12-4-7-19-8-5-12)17(14-1-2-14)11-13-3-6-16-10-13/h12-14,16H,1-11H2
InChIKeyNSBBQKJTYMZFAW-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.40
Rot. Bonds5

About N-cyclopropyl-2-(oxan-4-yl)-N-(pyrrolidin-3-ylmethyl)acetamide

N-cyclopropyl-2-(oxan-4-yl)-N-(pyrrolidin-3-ylmethyl)acetamide (PubChem CID 141152199) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is N-cyclopropyl-2-(oxan-4-yl)-N-(pyrrolidin-3-ylmethyl)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(oxan-4-yl)-N-(pyrrolidin-3-ylmethyl)acetamide
PubChem CID141152199
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC NameN-cyclopropyl-2-(oxan-4-yl)-N-(pyrrolidin-3-ylmethyl)acetamide
SMILESO=C(CC1CCOCC1)N(CC1CCNC1)C1CC1
InChIInChI=1S/C15H26N2O2/c18-15(9-12-4-7-19-8-5-12)17(14-1-2-14)11-13-3-6-16-10-13/h12-14,16H,1-11H2
InChIKeyNSBBQKJTYMZFAW-UHFFFAOYSA-N
XLogP1.40
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(oxan-4-yl)-N-(pyrrolidin-3-ylmethyl)acetamide?
The IUPAC name of N-cyclopropyl-2-(oxan-4-yl)-N-(pyrrolidin-3-ylmethyl)acetamide (CID 141152199) is N-cyclopropyl-2-(oxan-4-yl)-N-(pyrrolidin-3-ylmethyl)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(oxan-4-yl)-N-(pyrrolidin-3-ylmethyl)acetamide?
The canonical SMILES for N-cyclopropyl-2-(oxan-4-yl)-N-(pyrrolidin-3-ylmethyl)acetamide is O=C(CC1CCOCC1)N(CC1CCNC1)C1CC1.
What is the InChIKey of N-cyclopropyl-2-(oxan-4-yl)-N-(pyrrolidin-3-ylmethyl)acetamide?
The InChIKey is NSBBQKJTYMZFAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c18-15(9-12-4-7-19-8-5-12)17(14-1-2-14)11-13-3-6-16-10-13/h12-14,16H,1-11H2.
What are the key properties of N-cyclopropyl-2-(oxan-4-yl)-N-(pyrrolidin-3-ylmethyl)acetamide?
N-cyclopropyl-2-(oxan-4-yl)-N-(pyrrolidin-3-ylmethyl)acetamide has a molecular weight of 266.38 g/mol, XLogP of 1.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(oxan-4-yl)-N-(pyrrolidin-3-ylmethyl)acetamide is sourced from PubChem (CID 141152199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).