5-amino-N-methyl-N-(oxan-4-ylmethyl)hexanamide

C13H26N2O2 — CID 82852241

IUPAC5-amino-N-methyl-N-(oxan-4-ylmethyl)hexanamide
SMILESCC(N)CCCC(=O)N(C)CC1CCOCC1
InChIInChI=1S/C13H26N2O2/c1-11(14)4-3-5-13(16)15(2)10-12-6-8-17-9-7-12/h11-12H,3-10,14H2,1-2H3
InChIKeyCEGUWCGJXGFVAB-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.39
Rot. Bonds6

About 5-amino-N-methyl-N-(oxan-4-ylmethyl)hexanamide

5-amino-N-methyl-N-(oxan-4-ylmethyl)hexanamide (PubChem CID 82852241) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 5-amino-N-methyl-N-(oxan-4-ylmethyl)hexanamide.

Molecular Properties

Compound Name5-amino-N-methyl-N-(oxan-4-ylmethyl)hexanamide
PubChem CID82852241
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name5-amino-N-methyl-N-(oxan-4-ylmethyl)hexanamide
SMILESCC(N)CCCC(=O)N(C)CC1CCOCC1
InChIInChI=1S/C13H26N2O2/c1-11(14)4-3-5-13(16)15(2)10-12-6-8-17-9-7-12/h11-12H,3-10,14H2,1-2H3
InChIKeyCEGUWCGJXGFVAB-UHFFFAOYSA-N
XLogP1.39
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]hexanamide
CID 82851487
4-amino-N-methyl-N-[2-(oxan-4-yl)ethyl]pentanamide
CID 115156830
3-(2-aminoethoxy)-N-methyl-N-(oxan-4-ylmethyl)propanamide
CID 112739036
2-(4-aminocyclohexyl)-N-methyl-N-(oxan-4-ylmethyl)acetamide
CID 55226080
4-amino-N-(cyclopropylmethyl)-N-methylbutanamide
CID 60946266
5-amino-N-ethyl-N-methylhexanamide
CID 82848384
4-amino-N-methyl-N-[2-(oxan-4-yl)ethyl]butanamide
CID 115155515
oxan-4-ylmethyl 6-amino-2-methylheptanoate
CID 65285134
N-(cyclopropylmethyl)-N-methyl-4-(propan-2-ylamino)butanamide
CID 60946402
2-(1-aminocyclobutyl)-N-methyl-N-(oxan-4-ylmethyl)acetamide
CID 79853707
2-amino-N-[2-[methyl(oxan-4-ylmethyl)amino]-2-oxoethyl]acetamide
CID 63707976
(2R)-2-amino-N-methyl-N-(oxan-4-ylmethyl)-2-phenylacetamide
CID 63706468

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-methyl-N-(oxan-4-ylmethyl)hexanamide?
The IUPAC name of 5-amino-N-methyl-N-(oxan-4-ylmethyl)hexanamide (CID 82852241) is 5-amino-N-methyl-N-(oxan-4-ylmethyl)hexanamide.
What is the SMILES notation for 5-amino-N-methyl-N-(oxan-4-ylmethyl)hexanamide?
The canonical SMILES for 5-amino-N-methyl-N-(oxan-4-ylmethyl)hexanamide is CC(N)CCCC(=O)N(C)CC1CCOCC1.
What is the InChIKey of 5-amino-N-methyl-N-(oxan-4-ylmethyl)hexanamide?
The InChIKey is CEGUWCGJXGFVAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-11(14)4-3-5-13(16)15(2)10-12-6-8-17-9-7-12/h11-12H,3-10,14H2,1-2H3.
What are the key properties of 5-amino-N-methyl-N-(oxan-4-ylmethyl)hexanamide?
5-amino-N-methyl-N-(oxan-4-ylmethyl)hexanamide has a molecular weight of 242.36 g/mol, XLogP of 1.39, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-methyl-N-(oxan-4-ylmethyl)hexanamide is sourced from PubChem (CID 82852241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).