2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]propanamide

C9H18N2O2 — CID 112633408

IUPAC2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]propanamide
SMILESCC(NC1CC(O)C1(C)C)C(N)=O
InChIInChI=1S/C9H18N2O2/c1-5(8(10)13)11-6-4-7(12)9(6,2)3/h5-7,11-12H,4H2,1-3H3,(H2,10,13)
InChIKeyGAKOPBBXQZHNIO-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.39
Rot. Bonds3

About 2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]propanamide

2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]propanamide (PubChem CID 112633408) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is 2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]propanamide.

Molecular Properties

Compound Name2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]propanamide
PubChem CID112633408
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]propanamide
SMILESCC(NC1CC(O)C1(C)C)C(N)=O
InChIInChI=1S/C9H18N2O2/c1-5(8(10)13)11-6-4-7(12)9(6,2)3/h5-7,11-12H,4H2,1-3H3,(H2,10,13)
InChIKeyGAKOPBBXQZHNIO-UHFFFAOYSA-N
XLogP-0.39
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

methyl (2S)-2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]propanoate
CID 103948463
2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-(methylcarbamoyl)propanamide
CID 114629453
3-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-2-methylpropanamide
CID 114629418
N-ethyl-2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-methylpropanamide
CID 103107048
2-[(2,2,5,5-tetramethyloxolan-3-yl)amino]propanamide
CID 79916589
2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-(4-methylphenyl)propanamide
CID 114629421
4-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]pentanoic acid
CID 114629226
2,2-dimethyl-3-(4-methylpentan-2-ylamino)cyclobutan-1-ol
CID 112633394
2-cyclopropyl-2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]acetic acid
CID 103267221
2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]propane-1,3-diol
CID 112634110
(2R)-2-[(3,3-dimethylcyclobutyl)amino]propanamide
CID 130678752
3-[[(1R)-1-cyclopentylethyl]amino]-2,2-dimethylcyclobutan-1-ol
CID 103948487

Frequently Asked Questions

What is the IUPAC name of 2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]propanamide?
The IUPAC name of 2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]propanamide (CID 112633408) is 2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]propanamide.
What is the SMILES notation for 2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]propanamide?
The canonical SMILES for 2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]propanamide is CC(NC1CC(O)C1(C)C)C(N)=O.
What is the InChIKey of 2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]propanamide?
The InChIKey is GAKOPBBXQZHNIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-5(8(10)13)11-6-4-7(12)9(6,2)3/h5-7,11-12H,4H2,1-3H3,(H2,10,13).
What are the key properties of 2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]propanamide?
2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]propanamide has a molecular weight of 186.25 g/mol, XLogP of -0.39, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]propanamide is sourced from PubChem (CID 112633408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).