(2S)-2,4-dimethyl-2-propan-2-ylpentanamide

C10H21NO — CID 89006805

IUPAC(2S)-2,4-dimethyl-2-propan-2-ylpentanamide
SMILESCC(C)C[C@](C)(C(N)=O)C(C)C
InChIInChI=1S/C10H21NO/c1-7(2)6-10(5,8(3)4)9(11)12/h7-8H,6H2,1-5H3,(H2,11,12)/t10-/m0/s1
InChIKeyPUBFMALZNACDOY-JTQLQIEISA-N
MW171.28 g/mol
LogP2.18
Rot. Bonds4

About (2S)-2,4-dimethyl-2-propan-2-ylpentanamide

(2S)-2,4-dimethyl-2-propan-2-ylpentanamide (PubChem CID 89006805) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is (2S)-2,4-dimethyl-2-propan-2-ylpentanamide.

Molecular Properties

Compound Name(2S)-2,4-dimethyl-2-propan-2-ylpentanamide
PubChem CID89006805
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name(2S)-2,4-dimethyl-2-propan-2-ylpentanamide
SMILESCC(C)C[C@](C)(C(N)=O)C(C)C
InChIInChI=1S/C10H21NO/c1-7(2)6-10(5,8(3)4)9(11)12/h7-8H,6H2,1-5H3,(H2,11,12)/t10-/m0/s1
InChIKeyPUBFMALZNACDOY-JTQLQIEISA-N
XLogP2.18
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-2-amino-2,4-dimethylpentanamide
CID 14037824
4-methyl-2,2-bis(2-methylpropyl)pentanamide
CID 170848547
(2-hydroxy-4-methylpentyl) 2,4-dimethyl-2-propan-2-ylpentanoate
CID 167328919
2,3-dimethylbutan-2-yl 2,4-dimethyl-2-propan-2-ylpentanoate
CID 90329075
2-carbamoyl-2,4-dimethylpentanoic acid
CID 114899918
2-(dimethylamino)ethyl 2,4-dimethyl-2-propan-2-ylpentanoate
CID 88569261
CID 89383756
CID 89383756
2-dihydroxyphosphanyloxyethyl 2,4-dimethyl-2-propan-2-ylpentanoate
CID 123158747
2,2,3,3,4,4,4-heptafluorobutyl 2,4-dimethyl-2-propan-2-ylpentanoate
CID 88580459
4-carbamoyl-2,3,4-trimethylhexanoic acid
CID 139381047
2-methyl-2-propan-2-ylpropanediamide
CID 45122126
2,4-dimethylpentan-2-yl 2-methylpropanoate
CID 58385667

Frequently Asked Questions

What is the IUPAC name of (2S)-2,4-dimethyl-2-propan-2-ylpentanamide?
The IUPAC name of (2S)-2,4-dimethyl-2-propan-2-ylpentanamide (CID 89006805) is (2S)-2,4-dimethyl-2-propan-2-ylpentanamide.
What is the SMILES notation for (2S)-2,4-dimethyl-2-propan-2-ylpentanamide?
The canonical SMILES for (2S)-2,4-dimethyl-2-propan-2-ylpentanamide is CC(C)C[C@](C)(C(N)=O)C(C)C.
What is the InChIKey of (2S)-2,4-dimethyl-2-propan-2-ylpentanamide?
The InChIKey is PUBFMALZNACDOY-JTQLQIEISA-N. The full InChI is InChI=1S/C10H21NO/c1-7(2)6-10(5,8(3)4)9(11)12/h7-8H,6H2,1-5H3,(H2,11,12)/t10-/m0/s1.
What are the key properties of (2S)-2,4-dimethyl-2-propan-2-ylpentanamide?
(2S)-2,4-dimethyl-2-propan-2-ylpentanamide has a molecular weight of 171.28 g/mol, XLogP of 2.18, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2,4-dimethyl-2-propan-2-ylpentanamide is sourced from PubChem (CID 89006805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).