N-cyclopropyl-2-[(2,6-dimethyloxan-4-yl)amino]propanamide

C13H24N2O2 — CID 113406722

IUPACN-cyclopropyl-2-[(2,6-dimethyloxan-4-yl)amino]propanamide
SMILESCC1CC(NC(C)C(=O)NC2CC2)CC(C)O1
InChIInChI=1S/C13H24N2O2/c1-8-6-12(7-9(2)17-8)14-10(3)13(16)15-11-4-5-11/h8-12,14H,4-7H2,1-3H3,(H,15,16)
InChIKeyXDCMGMGWMJDSIV-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.20
Rot. Bonds4

About N-cyclopropyl-2-[(2,6-dimethyloxan-4-yl)amino]propanamide

N-cyclopropyl-2-[(2,6-dimethyloxan-4-yl)amino]propanamide (PubChem CID 113406722) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-cyclopropyl-2-[(2,6-dimethyloxan-4-yl)amino]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(2,6-dimethyloxan-4-yl)amino]propanamide
PubChem CID113406722
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN-cyclopropyl-2-[(2,6-dimethyloxan-4-yl)amino]propanamide
SMILESCC1CC(NC(C)C(=O)NC2CC2)CC(C)O1
InChIInChI=1S/C13H24N2O2/c1-8-6-12(7-9(2)17-8)14-10(3)13(16)15-11-4-5-11/h8-12,14H,4-7H2,1-3H3,(H,15,16)
InChIKeyXDCMGMGWMJDSIV-UHFFFAOYSA-N
XLogP1.20
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(2,6-dimethyloxan-4-yl)amino]propanamide?
The IUPAC name of N-cyclopropyl-2-[(2,6-dimethyloxan-4-yl)amino]propanamide (CID 113406722) is N-cyclopropyl-2-[(2,6-dimethyloxan-4-yl)amino]propanamide.
What is the SMILES notation for N-cyclopropyl-2-[(2,6-dimethyloxan-4-yl)amino]propanamide?
The canonical SMILES for N-cyclopropyl-2-[(2,6-dimethyloxan-4-yl)amino]propanamide is CC1CC(NC(C)C(=O)NC2CC2)CC(C)O1.
What is the InChIKey of N-cyclopropyl-2-[(2,6-dimethyloxan-4-yl)amino]propanamide?
The InChIKey is XDCMGMGWMJDSIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-8-6-12(7-9(2)17-8)14-10(3)13(16)15-11-4-5-11/h8-12,14H,4-7H2,1-3H3,(H,15,16).
What are the key properties of N-cyclopropyl-2-[(2,6-dimethyloxan-4-yl)amino]propanamide?
N-cyclopropyl-2-[(2,6-dimethyloxan-4-yl)amino]propanamide has a molecular weight of 240.35 g/mol, XLogP of 1.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(2,6-dimethyloxan-4-yl)amino]propanamide is sourced from PubChem (CID 113406722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).