3,4-dimethyl-3-propan-2-ylpentanamide

C10H21NO — CID 89429040

IUPAC3,4-dimethyl-3-propan-2-ylpentanamide
SMILESCC(C)C(C)(CC(N)=O)C(C)C
InChIInChI=1S/C10H21NO/c1-7(2)10(5,8(3)4)6-9(11)12/h7-8H,6H2,1-5H3,(H2,11,12)
InChIKeyHOLYOUIGMSKDMB-UHFFFAOYSA-N
MW171.28 g/mol
LogP2.18
Rot. Bonds4

About 3,4-dimethyl-3-propan-2-ylpentanamide

3,4-dimethyl-3-propan-2-ylpentanamide (PubChem CID 89429040) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 3,4-dimethyl-3-propan-2-ylpentanamide.

Molecular Properties

Compound Name3,4-dimethyl-3-propan-2-ylpentanamide
PubChem CID89429040
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name3,4-dimethyl-3-propan-2-ylpentanamide
SMILESCC(C)C(C)(CC(N)=O)C(C)C
InChIInChI=1S/C10H21NO/c1-7(2)10(5,8(3)4)6-9(11)12/h7-8H,6H2,1-5H3,(H2,11,12)
InChIKeyHOLYOUIGMSKDMB-UHFFFAOYSA-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

3-amino-3,4-dimethylhexanamide
CID 165482291
3-(2-amino-2-oxoethyl)-3-methylpentanediamide
CID 86237649
3,3-dichlorobutanamide
CID 57160976
3-hydroxy-5-methyl-3-(2-methylpropyl)hexanamide
CID 139781275
3-hydroxy-4-methyl-3-propan-2-ylhexanamide
CID 139781335
3,3-dimethylbutanamide;2-methanidyl-2-methylpropane;yttrium
CID 154649078
2-methyl-2-propan-2-ylpropanediamide
CID 45122126
3-[(2,3-diamino-3-oxopropyl)amino]-3-methylbutanamide
CID 106097393
3-(tert-butylcarbamoylamino)-3-methylbutanamide
CID 106096156
3,3,5-trimethyl-2-methylidenehexanamide
CID 139781680
3,4,5,5-tetramethyl-3-propan-2-ylhexanoic acid;yttrium
CID 161151978
3-(6-hydroxy-2,4-dioxo-5-propan-2-ylpyrimidin-1-yl)-3-methylbutanamide
CID 106098930

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-3-propan-2-ylpentanamide?
The IUPAC name of 3,4-dimethyl-3-propan-2-ylpentanamide (CID 89429040) is 3,4-dimethyl-3-propan-2-ylpentanamide.
What is the SMILES notation for 3,4-dimethyl-3-propan-2-ylpentanamide?
The canonical SMILES for 3,4-dimethyl-3-propan-2-ylpentanamide is CC(C)C(C)(CC(N)=O)C(C)C.
What is the InChIKey of 3,4-dimethyl-3-propan-2-ylpentanamide?
The InChIKey is HOLYOUIGMSKDMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-7(2)10(5,8(3)4)6-9(11)12/h7-8H,6H2,1-5H3,(H2,11,12).
What are the key properties of 3,4-dimethyl-3-propan-2-ylpentanamide?
3,4-dimethyl-3-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 3,4-dimethyl-3-propan-2-ylpentanamide is sourced from PubChem (CID 89429040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).