N-cyclopropyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide

C15H28N2O2 — CID 81043582

IUPACN-cyclopropyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide
SMILESCOCCN(C(=O)CC(C)C1CCCNC1)C1CC1
InChIInChI=1S/C15H28N2O2/c1-12(13-4-3-7-16-11-13)10-15(18)17(8-9-19-2)14-5-6-14/h12-14,16H,3-11H2,1-2H3
InChIKeyRBNTXCHCZGGAQV-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.65
Rot. Bonds7

About N-cyclopropyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide

N-cyclopropyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide (PubChem CID 81043582) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-cyclopropyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide
PubChem CID81043582
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC NameN-cyclopropyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide
SMILESCOCCN(C(=O)CC(C)C1CCCNC1)C1CC1
InChIInChI=1S/C15H28N2O2/c1-12(13-4-3-7-16-11-13)10-15(18)17(8-9-19-2)14-5-6-14/h12-14,16H,3-11H2,1-2H3
InChIKeyRBNTXCHCZGGAQV-UHFFFAOYSA-N
XLogP1.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide?
The IUPAC name of N-cyclopropyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide (CID 81043582) is N-cyclopropyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide.
What is the SMILES notation for N-cyclopropyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide?
The canonical SMILES for N-cyclopropyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide is COCCN(C(=O)CC(C)C1CCCNC1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide?
The InChIKey is RBNTXCHCZGGAQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-12(13-4-3-7-16-11-13)10-15(18)17(8-9-19-2)14-5-6-14/h12-14,16H,3-11H2,1-2H3.
What are the key properties of N-cyclopropyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide?
N-cyclopropyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide has a molecular weight of 268.40 g/mol, XLogP of 1.65, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(2-methoxyethyl)-3-piperidin-3-ylbutanamide is sourced from PubChem (CID 81043582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).