N-[(2-propan-2-yloxan-3-yl)methyl]morpholine-3-carboxamide

C14H26N2O3 — CID 119819551

IUPACN-[(2-propan-2-yloxan-3-yl)methyl]morpholine-3-carboxamide
SMILESCC(C)C1OCCCC1CNC(=O)C1COCCN1
InChIInChI=1S/C14H26N2O3/c1-10(2)13-11(4-3-6-19-13)8-16-14(17)12-9-18-7-5-15-12/h10-13,15H,3-9H2,1-2H3,(H,16,17)
InChIKeyPLSBAOKMDREXOK-UHFFFAOYSA-N
MW270.37 g/mol
LogP0.54
Rot. Bonds4

About N-[(2-propan-2-yloxan-3-yl)methyl]morpholine-3-carboxamide

N-[(2-propan-2-yloxan-3-yl)methyl]morpholine-3-carboxamide (PubChem CID 119819551) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is N-[(2-propan-2-yloxan-3-yl)methyl]morpholine-3-carboxamide.

Molecular Properties

Compound NameN-[(2-propan-2-yloxan-3-yl)methyl]morpholine-3-carboxamide
PubChem CID119819551
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC NameN-[(2-propan-2-yloxan-3-yl)methyl]morpholine-3-carboxamide
SMILESCC(C)C1OCCCC1CNC(=O)C1COCCN1
InChIInChI=1S/C14H26N2O3/c1-10(2)13-11(4-3-6-19-13)8-16-14(17)12-9-18-7-5-15-12/h10-13,15H,3-9H2,1-2H3,(H,16,17)
InChIKeyPLSBAOKMDREXOK-UHFFFAOYSA-N
XLogP0.54
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(2-propan-2-yloxan-3-yl)methyl]morpholine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(cyclooctylmethyl)morpholine-3-carboxamide;hydrochloride
CID 119741853
(3R)-N-ethylmorpholine-3-carboxamide
CID 96578732
3-amino-2-methyl-N-[(2-propan-2-yloxan-3-yl)methyl]butanamide;hydrochloride
CID 120502267
N-[[1-(3-methylbutyl)piperidin-4-yl]methyl]morpholine-3-carboxamide;dihydrochloride
CID 119898858
N-[(2,2-dimethylcyclopropyl)methyl]morpholine-3-carboxamide
CID 103811312
(2S)-2-amino-N-[(2-propan-2-yloxan-3-yl)methyl]propanamide;hydrochloride
CID 119344063
N-[(3-methylcyclohexyl)methyl]morpholine-3-carboxamide;hydrochloride
CID 119750252
N-[(2,2-dimethylcyclopropyl)methyl]morpholine-3-carboxamide;hydrochloride
CID 119785395
(3R)-N-[(2R)-2-methylsulfanylpropyl]morpholine-3-carboxamide
CID 99596683
1-amino-N-[(2-propan-2-yloxan-3-yl)methyl]cyclopropane-1-carboxamide
CID 119819545
2-(cyclopropylmethylamino)-N-[(2-propan-2-yloxan-3-yl)methyl]acetamide
CID 119819575
N-[(1,1-dioxothiolan-2-yl)methyl]morpholine-3-carboxamide
CID 81039320

Frequently Asked Questions

What is the IUPAC name of N-[(2-propan-2-yloxan-3-yl)methyl]morpholine-3-carboxamide?
The IUPAC name of N-[(2-propan-2-yloxan-3-yl)methyl]morpholine-3-carboxamide (CID 119819551) is N-[(2-propan-2-yloxan-3-yl)methyl]morpholine-3-carboxamide.
What is the SMILES notation for N-[(2-propan-2-yloxan-3-yl)methyl]morpholine-3-carboxamide?
The canonical SMILES for N-[(2-propan-2-yloxan-3-yl)methyl]morpholine-3-carboxamide is CC(C)C1OCCCC1CNC(=O)C1COCCN1.
What is the InChIKey of N-[(2-propan-2-yloxan-3-yl)methyl]morpholine-3-carboxamide?
The InChIKey is PLSBAOKMDREXOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-10(2)13-11(4-3-6-19-13)8-16-14(17)12-9-18-7-5-15-12/h10-13,15H,3-9H2,1-2H3,(H,16,17).
What are the key properties of N-[(2-propan-2-yloxan-3-yl)methyl]morpholine-3-carboxamide?
N-[(2-propan-2-yloxan-3-yl)methyl]morpholine-3-carboxamide has a molecular weight of 270.37 g/mol, XLogP of 0.54, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-propan-2-yloxan-3-yl)methyl]morpholine-3-carboxamide is sourced from PubChem (CID 119819551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).