2-[4-(methylamino)-2-propyloxan-4-yl]acetamide

C11H22N2O2 — CID 65236924

IUPAC2-[4-(methylamino)-2-propyloxan-4-yl]acetamide
SMILESCCCC1CC(CC(N)=O)(NC)CCO1
InChIInChI=1S/C11H22N2O2/c1-3-4-9-7-11(13-2,5-6-15-9)8-10(12)14/h9,13H,3-8H2,1-2H3,(H2,12,14)
InChIKeySXSITDSCPGUGIQ-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.80
Rot. Bonds5

About 2-[4-(methylamino)-2-propyloxan-4-yl]acetamide

2-[4-(methylamino)-2-propyloxan-4-yl]acetamide (PubChem CID 65236924) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 2-[4-(methylamino)-2-propyloxan-4-yl]acetamide.

Molecular Properties

Compound Name2-[4-(methylamino)-2-propyloxan-4-yl]acetamide
PubChem CID65236924
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name2-[4-(methylamino)-2-propyloxan-4-yl]acetamide
SMILESCCCC1CC(CC(N)=O)(NC)CCO1
InChIInChI=1S/C11H22N2O2/c1-3-4-9-7-11(13-2,5-6-15-9)8-10(12)14/h9,13H,3-8H2,1-2H3,(H2,12,14)
InChIKeySXSITDSCPGUGIQ-UHFFFAOYSA-N
XLogP0.80
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-methyl-4-(methylamino)oxan-4-yl]acetamide
CID 65236637
2-[2-ethyl-4-(ethylamino)oxan-4-yl]acetamide
CID 65234241
ethyl 2-(4-amino-2-propyloxan-4-yl)acetate
CID 79848209
2-[3,4-dimethyl-1-(methylamino)cyclohexyl]acetamide
CID 65236459
4-(aminomethyl)-N-(2,2-difluoroethyl)-2-propyloxan-4-amine
CID 115406424
4-(aminomethyl)-2-propyl-N-(2,2,2-trifluoroethyl)oxan-4-amine
CID 65378217
(2S,4R)-4-methyl-2-propyloxan-4-ol
CID 45083243
N-[4-(aminomethyl)-2-propyloxan-4-yl]piperidin-1-amine
CID 83010684
2-[4-(dimethylamino)-2-propyloxan-4-yl]acetic acid
CID 64526984
4-(aminomethyl)-N-but-3-ynyl-2-propyloxan-4-amine
CID 116641218
4-(aminomethyl)-N-(4-methylphenyl)-2-propyloxan-4-amine
CID 65376917
3-(4-hydroxy-2-propyloxan-4-yl)propanoic acid
CID 66322763

Frequently Asked Questions

What is the IUPAC name of 2-[4-(methylamino)-2-propyloxan-4-yl]acetamide?
The IUPAC name of 2-[4-(methylamino)-2-propyloxan-4-yl]acetamide (CID 65236924) is 2-[4-(methylamino)-2-propyloxan-4-yl]acetamide.
What is the SMILES notation for 2-[4-(methylamino)-2-propyloxan-4-yl]acetamide?
The canonical SMILES for 2-[4-(methylamino)-2-propyloxan-4-yl]acetamide is CCCC1CC(CC(N)=O)(NC)CCO1.
What is the InChIKey of 2-[4-(methylamino)-2-propyloxan-4-yl]acetamide?
The InChIKey is SXSITDSCPGUGIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-3-4-9-7-11(13-2,5-6-15-9)8-10(12)14/h9,13H,3-8H2,1-2H3,(H2,12,14).
What are the key properties of 2-[4-(methylamino)-2-propyloxan-4-yl]acetamide?
2-[4-(methylamino)-2-propyloxan-4-yl]acetamide has a molecular weight of 214.31 g/mol, XLogP of 0.80, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(methylamino)-2-propyloxan-4-yl]acetamide is sourced from PubChem (CID 65236924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).