2-hydroxy-N,N-di(propan-2-yl)butanamide

C10H21NO2 — CID 71365964

IUPAC2-hydroxy-N,N-di(propan-2-yl)butanamide
SMILESCCC(O)C(=O)N(C(C)C)C(C)C
InChIInChI=1S/C10H21NO2/c1-6-9(12)10(13)11(7(2)3)8(4)5/h7-9,12H,6H2,1-5H3
InChIKeyQVFBKXYWFNLPQC-UHFFFAOYSA-N
MW187.28 g/mol
LogP1.40
Rot. Bonds4

About 2-hydroxy-N,N-di(propan-2-yl)butanamide

2-hydroxy-N,N-di(propan-2-yl)butanamide (PubChem CID 71365964) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 2-hydroxy-N,N-di(propan-2-yl)butanamide.

Molecular Properties

Compound Name2-hydroxy-N,N-di(propan-2-yl)butanamide
PubChem CID71365964
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name2-hydroxy-N,N-di(propan-2-yl)butanamide
SMILESCCC(O)C(=O)N(C(C)C)C(C)C
InChIInChI=1S/C10H21NO2/c1-6-9(12)10(13)11(7(2)3)8(4)5/h7-9,12H,6H2,1-5H3
InChIKeyQVFBKXYWFNLPQC-UHFFFAOYSA-N
XLogP1.40
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-deuterio-2-methyl-N,N-di(propan-2-yl)propanamide
CID 11457949
(2R,3S,4S)-4-hydroxy-2,3-dimethyl-N,N-di(propan-2-yl)pentanamide
CID 10988048
2,3-dihydroxy-N',N'-di(propan-2-yl)butanediamide
CID 54099311
ethyl (3S,4R)-5-[di(propan-2-yl)amino]-3,4-dimethyl-5-oxopentanoate
CID 134905505
3-hydroxypentan-2-one;zinc
CID 174642767
(2R)-2-hydroxybutanethioic S-acid
CID 87799319
2-methyl-N,N-di(propan-2-yl)pent-4-enamide
CID 13197575
(Z,2R)-2,3-dimethyl-N,N-di(propan-2-yl)pent-3-enamide
CID 14921251
(Z,2S)-2,3-dimethyl-N,N-di(propan-2-yl)pent-3-enamide
CID 101053961
2-hydroxybutanamide;hydrochloride
CID 87384831
2-iodo-N-(4-methylhexan-2-yl)-N-propan-2-ylacetamide
CID 166800442
(3S)-1-amino-3-hydroxypentan-2-one
CID 126711962

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N,N-di(propan-2-yl)butanamide?
The IUPAC name of 2-hydroxy-N,N-di(propan-2-yl)butanamide (CID 71365964) is 2-hydroxy-N,N-di(propan-2-yl)butanamide.
What is the SMILES notation for 2-hydroxy-N,N-di(propan-2-yl)butanamide?
The canonical SMILES for 2-hydroxy-N,N-di(propan-2-yl)butanamide is CCC(O)C(=O)N(C(C)C)C(C)C.
What is the InChIKey of 2-hydroxy-N,N-di(propan-2-yl)butanamide?
The InChIKey is QVFBKXYWFNLPQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-6-9(12)10(13)11(7(2)3)8(4)5/h7-9,12H,6H2,1-5H3.
What are the key properties of 2-hydroxy-N,N-di(propan-2-yl)butanamide?
2-hydroxy-N,N-di(propan-2-yl)butanamide has a molecular weight of 187.28 g/mol, XLogP of 1.40, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N,N-di(propan-2-yl)butanamide is sourced from PubChem (CID 71365964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).