2-methyl-4-(oxolan-2-ylmethoxy)-2-(propan-2-ylamino)pentanamide

C14H28N2O3 — CID 64706325

IUPAC2-methyl-4-(oxolan-2-ylmethoxy)-2-(propan-2-ylamino)pentanamide
SMILESCC(C)NC(C)(CC(C)OCC1CCCO1)C(N)=O
InChIInChI=1S/C14H28N2O3/c1-10(2)16-14(4,13(15)17)8-11(3)19-9-12-6-5-7-18-12/h10-12,16H,5-9H2,1-4H3,(H2,15,17)
InChIKeyYCUBWDJHFKYNJX-UHFFFAOYSA-N
MW272.39 g/mol
LogP1.20
Rot. Bonds8

About 2-methyl-4-(oxolan-2-ylmethoxy)-2-(propan-2-ylamino)pentanamide

2-methyl-4-(oxolan-2-ylmethoxy)-2-(propan-2-ylamino)pentanamide (PubChem CID 64706325) has the molecular formula C14H28N2O3 and a molecular weight of 272.39 g/mol. Its IUPAC name is 2-methyl-4-(oxolan-2-ylmethoxy)-2-(propan-2-ylamino)pentanamide.

Molecular Properties

Compound Name2-methyl-4-(oxolan-2-ylmethoxy)-2-(propan-2-ylamino)pentanamide
PubChem CID64706325
Molecular FormulaC14H28N2O3
Molecular Weight272.39 g/mol
Exact Mass272.21
IUPAC Name2-methyl-4-(oxolan-2-ylmethoxy)-2-(propan-2-ylamino)pentanamide
SMILESCC(C)NC(C)(CC(C)OCC1CCCO1)C(N)=O
InChIInChI=1S/C14H28N2O3/c1-10(2)16-14(4,13(15)17)8-11(3)19-9-12-6-5-7-18-12/h10-12,16H,5-9H2,1-4H3,(H2,15,17)
InChIKeyYCUBWDJHFKYNJX-UHFFFAOYSA-N
XLogP1.20
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-amino-2-methyl-4-(oxolan-2-ylmethoxy)pentanoate
CID 64708810
4-(2-cyclopropylethoxy)-2-methyl-2-(propan-2-ylamino)pentanamide
CID 114157820
4-ethoxy-2-methyl-2-(propan-2-ylamino)pentanamide
CID 64707210
(3R)-3-(oxolan-2-ylmethoxy)butanoic acid
CID 103547787
[(2S)-2-(oxolan-2-ylmethoxy)propyl] prop-2-enoate
CID 139420667
2,5-dimethyl-2-(oxolan-2-ylmethylamino)hexanamide
CID 54891779
2-methyl-2-(methylamino)-4-[methyl(oxan-2-ylmethyl)amino]pentanamide
CID 64711413
2-(cyclopropylamino)-2-methyl-4-(oxan-4-ylmethoxy)pentanamide
CID 64721587
2-methyl-3-(oxolan-2-ylmethoxy)-2-(propan-2-ylamino)propan-1-ol
CID 64805051
ethyl 4-(2-cyclopropylethoxy)-2-methyl-2-(propan-2-ylamino)pentanoate
CID 106204438
ethyl 4-[ethyl(oxolan-2-ylmethyl)amino]-2-methyl-2-(methylamino)pentanoate
CID 64710254
N-(1-amino-2-methylpropan-2-yl)-2-(oxan-2-ylmethoxy)propanamide;hydrochloride
CID 119525083

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(oxolan-2-ylmethoxy)-2-(propan-2-ylamino)pentanamide?
The IUPAC name of 2-methyl-4-(oxolan-2-ylmethoxy)-2-(propan-2-ylamino)pentanamide (CID 64706325) is 2-methyl-4-(oxolan-2-ylmethoxy)-2-(propan-2-ylamino)pentanamide.
What is the SMILES notation for 2-methyl-4-(oxolan-2-ylmethoxy)-2-(propan-2-ylamino)pentanamide?
The canonical SMILES for 2-methyl-4-(oxolan-2-ylmethoxy)-2-(propan-2-ylamino)pentanamide is CC(C)NC(C)(CC(C)OCC1CCCO1)C(N)=O.
What is the InChIKey of 2-methyl-4-(oxolan-2-ylmethoxy)-2-(propan-2-ylamino)pentanamide?
The InChIKey is YCUBWDJHFKYNJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O3/c1-10(2)16-14(4,13(15)17)8-11(3)19-9-12-6-5-7-18-12/h10-12,16H,5-9H2,1-4H3,(H2,15,17).
What are the key properties of 2-methyl-4-(oxolan-2-ylmethoxy)-2-(propan-2-ylamino)pentanamide?
2-methyl-4-(oxolan-2-ylmethoxy)-2-(propan-2-ylamino)pentanamide has a molecular weight of 272.39 g/mol, XLogP of 1.20, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(oxolan-2-ylmethoxy)-2-(propan-2-ylamino)pentanamide is sourced from PubChem (CID 64706325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).