2-(3-hydroxy-7-methyl-2-azaspiro[3.5]nonan-2-yl)pentanediamide

C14H25N3O3 — CID 134244859

IUPAC2-(3-hydroxy-7-methyl-2-azaspiro[3.5]nonan-2-yl)pentanediamide
SMILESCC1CCC2(CC1)CN(C(CCC(N)=O)C(N)=O)C2O
InChIInChI=1S/C14H25N3O3/c1-9-4-6-14(7-5-9)8-17(13(14)20)10(12(16)19)2-3-11(15)18/h9-10,13,20H,2-8H2,1H3,(H2,15,18)(H2,16,19)
InChIKeyZJNQFKJAYGNORV-UHFFFAOYSA-N
MW283.37 g/mol
LogP-0.06
Rot. Bonds5

About 2-(3-hydroxy-7-methyl-2-azaspiro[3.5]nonan-2-yl)pentanediamide

2-(3-hydroxy-7-methyl-2-azaspiro[3.5]nonan-2-yl)pentanediamide (PubChem CID 134244859) has the molecular formula C14H25N3O3 and a molecular weight of 283.37 g/mol. Its IUPAC name is 2-(3-hydroxy-7-methyl-2-azaspiro[3.5]nonan-2-yl)pentanediamide.

Molecular Properties

Compound Name2-(3-hydroxy-7-methyl-2-azaspiro[3.5]nonan-2-yl)pentanediamide
PubChem CID134244859
Molecular FormulaC14H25N3O3
Molecular Weight283.37 g/mol
Exact Mass283.19
IUPAC Name2-(3-hydroxy-7-methyl-2-azaspiro[3.5]nonan-2-yl)pentanediamide
SMILESCC1CCC2(CC1)CN(C(CCC(N)=O)C(N)=O)C2O
InChIInChI=1S/C14H25N3O3/c1-9-4-6-14(7-5-9)8-17(13(14)20)10(12(16)19)2-3-11(15)18/h9-10,13,20H,2-8H2,1H3,(H2,15,18)(H2,16,19)
InChIKeyZJNQFKJAYGNORV-UHFFFAOYSA-N
XLogP-0.06
TPSA109.65 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 5-0.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-methylpentanediamide
CID 19688970
(2R)-2-methylpentanediamide
CID 90202517
3-(2-amino-2-oxoethyl)sulfanyl-N-[(1-hydroxy-4-methylcyclohexyl)methyl]propanamide
CID 65119498
5-amino-2-[(4-methylpiperidine-1-carbonyl)amino]-5-oxopentanoic acid
CID 61188573
(2S)-2-[1-[(2R)-2-amino-3-sulfanylpropanoyl]-6-oxo-1,7-diazaspiro[4.4]nonan-7-yl]pentanediamide
CID 134243495
2-amino-1-(1,4-dimethylcyclohexyl)ethanone
CID 70477833
3-[(1-hydroxy-4-methylcyclohexyl)methylamino]-2-methylpropanamide
CID 65116289
6-amino-N-[(1-hydroxy-4-methylcyclohexyl)methyl]-4-methylhexanamide
CID 65120023
[1-(aminomethyl)-4-methylcyclohexyl]-(3,4-dihydroxypyrrolidin-1-yl)methanone
CID 106669058
3-hydroxypropanamide;7-methyl-2-azaspiro[3.5]nonan-3-one
CID 142283729
(3R)-3-hydroxy-2-(7-methyl-3-oxo-2-azaspiro[3.5]nonan-2-yl)butanamide
CID 134244857
(4R)-4-methyl-1-(5-methyl-2-oxohexan-3-yl)cycloheptane-1-carboxamide
CID 147297565

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxy-7-methyl-2-azaspiro[3.5]nonan-2-yl)pentanediamide?
The IUPAC name of 2-(3-hydroxy-7-methyl-2-azaspiro[3.5]nonan-2-yl)pentanediamide (CID 134244859) is 2-(3-hydroxy-7-methyl-2-azaspiro[3.5]nonan-2-yl)pentanediamide.
What is the SMILES notation for 2-(3-hydroxy-7-methyl-2-azaspiro[3.5]nonan-2-yl)pentanediamide?
The canonical SMILES for 2-(3-hydroxy-7-methyl-2-azaspiro[3.5]nonan-2-yl)pentanediamide is CC1CCC2(CC1)CN(C(CCC(N)=O)C(N)=O)C2O.
What is the InChIKey of 2-(3-hydroxy-7-methyl-2-azaspiro[3.5]nonan-2-yl)pentanediamide?
The InChIKey is ZJNQFKJAYGNORV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O3/c1-9-4-6-14(7-5-9)8-17(13(14)20)10(12(16)19)2-3-11(15)18/h9-10,13,20H,2-8H2,1H3,(H2,15,18)(H2,16,19).
What are the key properties of 2-(3-hydroxy-7-methyl-2-azaspiro[3.5]nonan-2-yl)pentanediamide?
2-(3-hydroxy-7-methyl-2-azaspiro[3.5]nonan-2-yl)pentanediamide has a molecular weight of 283.37 g/mol, XLogP of -0.06, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxy-7-methyl-2-azaspiro[3.5]nonan-2-yl)pentanediamide is sourced from PubChem (CID 134244859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).