N,4-dimethyl-2-(oxan-4-ylmethylamino)pentanamide

C13H26N2O2 — CID 55065982

IUPACN,4-dimethyl-2-(oxan-4-ylmethylamino)pentanamide
SMILESCNC(=O)C(CC(C)C)NCC1CCOCC1
InChIInChI=1S/C13H26N2O2/c1-10(2)8-12(13(16)14-3)15-9-11-4-6-17-7-5-11/h10-12,15H,4-9H2,1-3H3,(H,14,16)
InChIKeyPIBOANRGJZYTBE-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.16
Rot. Bonds6

About N,4-dimethyl-2-(oxan-4-ylmethylamino)pentanamide

N,4-dimethyl-2-(oxan-4-ylmethylamino)pentanamide (PubChem CID 55065982) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is N,4-dimethyl-2-(oxan-4-ylmethylamino)pentanamide.

Molecular Properties

Compound NameN,4-dimethyl-2-(oxan-4-ylmethylamino)pentanamide
PubChem CID55065982
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC NameN,4-dimethyl-2-(oxan-4-ylmethylamino)pentanamide
SMILESCNC(=O)C(CC(C)C)NCC1CCOCC1
InChIInChI=1S/C13H26N2O2/c1-10(2)8-12(13(16)14-3)15-9-11-4-6-17-7-5-11/h10-12,15H,4-9H2,1-3H3,(H,14,16)
InChIKeyPIBOANRGJZYTBE-UHFFFAOYSA-N
XLogP1.16
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclohex-3-en-1-ylmethylamino)-N,4-dimethylpentanamide
CID 43750476
(2S)-4-methyl-2-(oxan-4-ylmethylamino)pentan-1-ol
CID 94422130
2-(oxan-4-ylmethylamino)-N-propan-2-ylpropanamide
CID 63711162
methyl 2-(oxan-4-ylmethylamino)propanoate
CID 62385686
ethyl 2-(oxan-4-ylmethylamino)butanoate
CID 64670157
N-tert-butyl-2-(oxan-4-ylmethylamino)propanamide
CID 55210335
2-(2-bicyclo[2.2.1]hept-5-enylmethylamino)-N,4-dimethylpentanamide
CID 43792150
N,4-dimethyl-2-(methylamino)pentanamide
CID 72516454
N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]cyclopropanecarboxamide
CID 60776170
2-(cyclohexylmethylamino)-N,N,4-trimethylpentanamide
CID 43674999
N-butyl-2-(oxan-4-ylmethylamino)propanamide
CID 62351557
2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-N,4-dimethylpentanamide
CID 43750672

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-2-(oxan-4-ylmethylamino)pentanamide?
The IUPAC name of N,4-dimethyl-2-(oxan-4-ylmethylamino)pentanamide (CID 55065982) is N,4-dimethyl-2-(oxan-4-ylmethylamino)pentanamide.
What is the SMILES notation for N,4-dimethyl-2-(oxan-4-ylmethylamino)pentanamide?
The canonical SMILES for N,4-dimethyl-2-(oxan-4-ylmethylamino)pentanamide is CNC(=O)C(CC(C)C)NCC1CCOCC1.
What is the InChIKey of N,4-dimethyl-2-(oxan-4-ylmethylamino)pentanamide?
The InChIKey is PIBOANRGJZYTBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-10(2)8-12(13(16)14-3)15-9-11-4-6-17-7-5-11/h10-12,15H,4-9H2,1-3H3,(H,14,16).
What are the key properties of N,4-dimethyl-2-(oxan-4-ylmethylamino)pentanamide?
N,4-dimethyl-2-(oxan-4-ylmethylamino)pentanamide has a molecular weight of 242.36 g/mol, XLogP of 1.16, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-2-(oxan-4-ylmethylamino)pentanamide is sourced from PubChem (CID 55065982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).