(2R)-N-methyl-2-propan-2-ylpentanamide

C9H19NO — CID 126694823

IUPAC(2R)-N-methyl-2-propan-2-ylpentanamide
SMILESCCC[C@@H](C(=O)NC)C(C)C
InChIInChI=1S/C9H19NO/c1-5-6-8(7(2)3)9(11)10-4/h7-8H,5-6H2,1-4H3,(H,10,11)/t8-/m1/s1
InChIKeyJCTKCAKUPTVEEK-MRVPVSSYSA-N
MW157.26 g/mol
LogP1.80
Rot. Bonds4

About (2R)-N-methyl-2-propan-2-ylpentanamide

(2R)-N-methyl-2-propan-2-ylpentanamide (PubChem CID 126694823) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is (2R)-N-methyl-2-propan-2-ylpentanamide.

Molecular Properties

Compound Name(2R)-N-methyl-2-propan-2-ylpentanamide
PubChem CID126694823
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name(2R)-N-methyl-2-propan-2-ylpentanamide
SMILESCCC[C@@H](C(=O)NC)C(C)C
InChIInChI=1S/C9H19NO/c1-5-6-8(7(2)3)9(11)10-4/h7-8H,5-6H2,1-4H3,(H,10,11)/t8-/m1/s1
InChIKeyJCTKCAKUPTVEEK-MRVPVSSYSA-N
XLogP1.80
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;2-propan-2-ylpentanoic acid
CID 175540570
(4R)-4-propan-2-ylheptan-3-one
CID 95003187
(2S)-N-methyl-2-(methylamino)pentanamide
CID 143782023
2-ethyl-N-methylpentanamide
CID 55287466
(2R)-N-[(3S)-oxolan-3-yl]-2-propan-2-ylpentanamide
CID 97329335
2-ethyl-N-methylpentanamide;molecular hydrogen
CID 142188922
(2R)-2-amino-N-[1-(methylamino)-1-oxopropan-2-yl]pentanamide
CID 103795688
N-carbamoyl-2-propan-2-ylhexanamide
CID 175202627
3-(methylcarbamoyl)pentadecane-2-sulfonic acid
CID 122612573
(2R)-pentane-1,1,2-tricarboxylic acid
CID 54153831
3-methyl-2-(2-methylpentanoylamino)butanoic acid
CID 43209765
(2S)-2-[[1-(methylamino)-1-oxopropan-2-yl]carbamoylamino]pentanoic acid
CID 107566458

Frequently Asked Questions

What is the IUPAC name of (2R)-N-methyl-2-propan-2-ylpentanamide?
The IUPAC name of (2R)-N-methyl-2-propan-2-ylpentanamide (CID 126694823) is (2R)-N-methyl-2-propan-2-ylpentanamide.
What is the SMILES notation for (2R)-N-methyl-2-propan-2-ylpentanamide?
The canonical SMILES for (2R)-N-methyl-2-propan-2-ylpentanamide is CCC[C@@H](C(=O)NC)C(C)C.
What is the InChIKey of (2R)-N-methyl-2-propan-2-ylpentanamide?
The InChIKey is JCTKCAKUPTVEEK-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H19NO/c1-5-6-8(7(2)3)9(11)10-4/h7-8H,5-6H2,1-4H3,(H,10,11)/t8-/m1/s1.
What are the key properties of (2R)-N-methyl-2-propan-2-ylpentanamide?
(2R)-N-methyl-2-propan-2-ylpentanamide has a molecular weight of 157.26 g/mol, XLogP of 1.80, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-methyl-2-propan-2-ylpentanamide is sourced from PubChem (CID 126694823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).