2-(butan-2-ylamino)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide

C12H24N2O2 — CID 114629653

IUPAC2-(butan-2-ylamino)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide
SMILESCCC(C)NCC(=O)NC1CC(O)C1(C)C
InChIInChI=1S/C12H24N2O2/c1-5-8(2)13-7-11(16)14-9-6-10(15)12(9,3)4/h8-10,13,15H,5-7H2,1-4H3,(H,14,16)
InChIKeyVYJSBIPSHXFDHT-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.65
Rot. Bonds5

About 2-(butan-2-ylamino)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide

2-(butan-2-ylamino)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide (PubChem CID 114629653) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-(butan-2-ylamino)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide.

Molecular Properties

Compound Name2-(butan-2-ylamino)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide
PubChem CID114629653
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-(butan-2-ylamino)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide
SMILESCCC(C)NCC(=O)NC1CC(O)C1(C)C
InChIInChI=1S/C12H24N2O2/c1-5-8(2)13-7-11(16)14-9-6-10(15)12(9,3)4/h8-10,13,15H,5-7H2,1-4H3,(H,14,16)
InChIKeyVYJSBIPSHXFDHT-UHFFFAOYSA-N
XLogP0.65
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-hydroxy-2,2-dimethylcyclobutyl)-3-methylbutanamide
CID 114631068
(2R)-2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)butanamide
CID 104940471
(2S)-2-amino-N-[2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-2-oxoethyl]-3-methylbutanamide
CID 104940473
2-(butan-2-ylamino)-N-(2-methylcyclopropyl)acetamide
CID 62398768
N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-propan-2-ylsulfanylacetamide
CID 114630472
2-(butan-2-ylamino)-N-(4-hydroxycyclohexyl)acetamide
CID 60852285
3-(ethylamino)-N-(3-hydroxy-2,2-dimethylcyclobutyl)propanamide
CID 114629835
2-(butan-2-ylamino)-N-(3,3-dimethylcyclopentyl)acetamide
CID 114546344
4-chloro-N-(3-hydroxy-2,2-dimethylcyclobutyl)butanamide
CID 114629316
5-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)pentanamide
CID 114629795
2-(azetidin-3-yl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide
CID 114629789
2-[2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-2-oxoethoxy]acetic acid
CID 114628859

Frequently Asked Questions

What is the IUPAC name of 2-(butan-2-ylamino)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide?
The IUPAC name of 2-(butan-2-ylamino)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide (CID 114629653) is 2-(butan-2-ylamino)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide.
What is the SMILES notation for 2-(butan-2-ylamino)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide?
The canonical SMILES for 2-(butan-2-ylamino)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide is CCC(C)NCC(=O)NC1CC(O)C1(C)C.
What is the InChIKey of 2-(butan-2-ylamino)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide?
The InChIKey is VYJSBIPSHXFDHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-5-8(2)13-7-11(16)14-9-6-10(15)12(9,3)4/h8-10,13,15H,5-7H2,1-4H3,(H,14,16).
What are the key properties of 2-(butan-2-ylamino)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide?
2-(butan-2-ylamino)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide has a molecular weight of 228.34 g/mol, XLogP of 0.65, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(butan-2-ylamino)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide is sourced from PubChem (CID 114629653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).