3-cyclopentyl-N-(2-cyclopropyloxan-4-yl)propanamide

C16H27NO2 — CID 75458056

IUPAC3-cyclopentyl-N-(2-cyclopropyloxan-4-yl)propanamide
SMILESO=C(CCC1CCCC1)NC1CCOC(C2CC2)C1
InChIInChI=1S/C16H27NO2/c18-16(8-5-12-3-1-2-4-12)17-14-9-10-19-15(11-14)13-6-7-13/h12-15H,1-11H2,(H,17,18)
InChIKeyMVNDNQXSGSRBFJ-UHFFFAOYSA-N
MW265.40 g/mol
LogP3.03
Rot. Bonds5

About 3-cyclopentyl-N-(2-cyclopropyloxan-4-yl)propanamide

3-cyclopentyl-N-(2-cyclopropyloxan-4-yl)propanamide (PubChem CID 75458056) has the molecular formula C16H27NO2 and a molecular weight of 265.40 g/mol. Its IUPAC name is 3-cyclopentyl-N-(2-cyclopropyloxan-4-yl)propanamide.

Molecular Properties

Compound Name3-cyclopentyl-N-(2-cyclopropyloxan-4-yl)propanamide
PubChem CID75458056
Molecular FormulaC16H27NO2
Molecular Weight265.40 g/mol
Exact Mass265.20
IUPAC Name3-cyclopentyl-N-(2-cyclopropyloxan-4-yl)propanamide
SMILESO=C(CCC1CCCC1)NC1CCOC(C2CC2)C1
InChIInChI=1S/C16H27NO2/c18-16(8-5-12-3-1-2-4-12)17-14-9-10-19-15(11-14)13-6-7-13/h12-15H,1-11H2,(H,17,18)
InChIKeyMVNDNQXSGSRBFJ-UHFFFAOYSA-N
XLogP3.03
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-(2-cyclopropyloxan-4-yl)propanamide?
The IUPAC name of 3-cyclopentyl-N-(2-cyclopropyloxan-4-yl)propanamide (CID 75458056) is 3-cyclopentyl-N-(2-cyclopropyloxan-4-yl)propanamide.
What is the SMILES notation for 3-cyclopentyl-N-(2-cyclopropyloxan-4-yl)propanamide?
The canonical SMILES for 3-cyclopentyl-N-(2-cyclopropyloxan-4-yl)propanamide is O=C(CCC1CCCC1)NC1CCOC(C2CC2)C1.
What is the InChIKey of 3-cyclopentyl-N-(2-cyclopropyloxan-4-yl)propanamide?
The InChIKey is MVNDNQXSGSRBFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO2/c18-16(8-5-12-3-1-2-4-12)17-14-9-10-19-15(11-14)13-6-7-13/h12-15H,1-11H2,(H,17,18).
What are the key properties of 3-cyclopentyl-N-(2-cyclopropyloxan-4-yl)propanamide?
3-cyclopentyl-N-(2-cyclopropyloxan-4-yl)propanamide has a molecular weight of 265.40 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-(2-cyclopropyloxan-4-yl)propanamide is sourced from PubChem (CID 75458056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).