2-(2,6-dioxaspiro[4.5]decan-9-ylamino)-N-(2-methylpropyl)propanamide

C15H28N2O3 — CID 115885270

IUPAC2-(2,6-dioxaspiro[4.5]decan-9-ylamino)-N-(2-methylpropyl)propanamide
SMILESCC(C)CNC(=O)C(C)NC1CCOC2(CCOC2)C1
InChIInChI=1S/C15H28N2O3/c1-11(2)9-16-14(18)12(3)17-13-4-6-20-15(8-13)5-7-19-10-15/h11-13,17H,4-10H2,1-3H3,(H,16,18)
InChIKeyYMDZTBKAHQVFBZ-UHFFFAOYSA-N
MW284.40 g/mol
LogP1.07
Rot. Bonds5

About 2-(2,6-dioxaspiro[4.5]decan-9-ylamino)-N-(2-methylpropyl)propanamide

2-(2,6-dioxaspiro[4.5]decan-9-ylamino)-N-(2-methylpropyl)propanamide (PubChem CID 115885270) has the molecular formula C15H28N2O3 and a molecular weight of 284.40 g/mol. Its IUPAC name is 2-(2,6-dioxaspiro[4.5]decan-9-ylamino)-N-(2-methylpropyl)propanamide.

Molecular Properties

Compound Name2-(2,6-dioxaspiro[4.5]decan-9-ylamino)-N-(2-methylpropyl)propanamide
PubChem CID115885270
Molecular FormulaC15H28N2O3
Molecular Weight284.40 g/mol
Exact Mass284.21
IUPAC Name2-(2,6-dioxaspiro[4.5]decan-9-ylamino)-N-(2-methylpropyl)propanamide
SMILESCC(C)CNC(=O)C(C)NC1CCOC2(CCOC2)C1
InChIInChI=1S/C15H28N2O3/c1-11(2)9-16-14(18)12(3)17-13-4-6-20-15(8-13)5-7-19-10-15/h11-13,17H,4-10H2,1-3H3,(H,16,18)
InChIKeyYMDZTBKAHQVFBZ-UHFFFAOYSA-N
XLogP1.07
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1,9-dioxaspiro[5.5]undecan-4-ylamino)-N-(2-methylpropyl)propanamide
CID 115733463
2-[(2,2-dimethyloxan-4-yl)amino]-N-(2-methylpropyl)propanamide
CID 83032742
N-(2-methylpropyl)-2,6-dioxaspiro[4.5]decan-9-amine
CID 79898440
2-(2,6-dioxaspiro[4.5]decan-9-ylamino)-4-methylpentanoic acid
CID 79894126
N-butan-2-yl-2,6-dioxaspiro[4.5]decan-9-amine
CID 79898146
N-methyl-2-(5-oxaspiro[3.5]nonan-8-ylamino)propanamide
CID 79895294
N-(2,3-dimethylbutyl)-2,6-dioxaspiro[4.5]decan-9-amine
CID 79903290
N-[(1S)-1-cyclohexylethyl]-2,6-dioxaspiro[4.5]decan-9-amine
CID 81384866
N-(2-methylbutyl)-2,6-dioxaspiro[4.5]decan-9-amine
CID 79903955
N-(dicyclopropylmethyl)-2,6-dioxaspiro[4.5]decan-9-amine
CID 79895513
N-(1-ethoxypropan-2-yl)-2,6-dioxaspiro[4.5]decan-9-amine
CID 79895528
N-tert-butyl-2-(6-oxaspiro[4.5]decan-9-ylamino)propanamide
CID 115731804

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dioxaspiro[4.5]decan-9-ylamino)-N-(2-methylpropyl)propanamide?
The IUPAC name of 2-(2,6-dioxaspiro[4.5]decan-9-ylamino)-N-(2-methylpropyl)propanamide (CID 115885270) is 2-(2,6-dioxaspiro[4.5]decan-9-ylamino)-N-(2-methylpropyl)propanamide.
What is the SMILES notation for 2-(2,6-dioxaspiro[4.5]decan-9-ylamino)-N-(2-methylpropyl)propanamide?
The canonical SMILES for 2-(2,6-dioxaspiro[4.5]decan-9-ylamino)-N-(2-methylpropyl)propanamide is CC(C)CNC(=O)C(C)NC1CCOC2(CCOC2)C1.
What is the InChIKey of 2-(2,6-dioxaspiro[4.5]decan-9-ylamino)-N-(2-methylpropyl)propanamide?
The InChIKey is YMDZTBKAHQVFBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3/c1-11(2)9-16-14(18)12(3)17-13-4-6-20-15(8-13)5-7-19-10-15/h11-13,17H,4-10H2,1-3H3,(H,16,18).
What are the key properties of 2-(2,6-dioxaspiro[4.5]decan-9-ylamino)-N-(2-methylpropyl)propanamide?
2-(2,6-dioxaspiro[4.5]decan-9-ylamino)-N-(2-methylpropyl)propanamide has a molecular weight of 284.40 g/mol, XLogP of 1.07, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dioxaspiro[4.5]decan-9-ylamino)-N-(2-methylpropyl)propanamide is sourced from PubChem (CID 115885270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).