(2R)-2-amino-N-ethyl-N-(2-methylprop-2-enyl)pentanamide

C11H22N2O — CID 107568096

IUPAC(2R)-2-amino-N-ethyl-N-(2-methylprop-2-enyl)pentanamide
SMILESC=C(C)CN(CC)C(=O)[C@H](N)CCC
InChIInChI=1S/C11H22N2O/c1-5-7-10(12)11(14)13(6-2)8-9(3)4/h10H,3,5-8,12H2,1-2,4H3/t10-/m1/s1
InChIKeyFDYSWUPONQBSIR-SNVBAGLBSA-N
MW198.31 g/mol
LogP1.54
Rot. Bonds6

About (2R)-2-amino-N-ethyl-N-(2-methylprop-2-enyl)pentanamide

(2R)-2-amino-N-ethyl-N-(2-methylprop-2-enyl)pentanamide (PubChem CID 107568096) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is (2R)-2-amino-N-ethyl-N-(2-methylprop-2-enyl)pentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-ethyl-N-(2-methylprop-2-enyl)pentanamide
PubChem CID107568096
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name(2R)-2-amino-N-ethyl-N-(2-methylprop-2-enyl)pentanamide
SMILESC=C(C)CN(CC)C(=O)[C@H](N)CCC
InChIInChI=1S/C11H22N2O/c1-5-7-10(12)11(14)13(6-2)8-9(3)4/h10H,3,5-8,12H2,1-2,4H3/t10-/m1/s1
InChIKeyFDYSWUPONQBSIR-SNVBAGLBSA-N
XLogP1.54
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-amino-N-ethyl-N-(2-methylprop-2-enyl)-4-phenylbutanamide
CID 104983828
(2R)-2-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide
CID 93367275
(2R)-2-amino-N-ethyl-N-(2-ethylbutyl)pentanamide
CID 103795380
N-ethyl-2-methyl-N-(2-methylprop-2-enyl)propanamide
CID 60660134
(2R)-2-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)pentanamide
CID 107570081
3-[[(2R)-2-aminopentanoyl]-ethylamino]-2-methylpropanoic acid
CID 103869271
2-chloro-N-ethyl-N-(2-methylprop-2-enyl)propanamide
CID 24703589
(2R)-2-amino-N,N-dibutylpentanamide
CID 103793770
(2S)-2-amino-N-(2-ethoxyethyl)-N-ethylpentanamide
CID 107569737
(2R)-2-amino-N-ethyl-N-methylpentanamide
CID 93255557
(2R)-2-amino-N,N-dipentylpentanamide
CID 93372351
3-amino-N-ethyl-2-methoxy-N-(2-methylprop-2-enyl)propanamide
CID 106111177

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-ethyl-N-(2-methylprop-2-enyl)pentanamide?
The IUPAC name of (2R)-2-amino-N-ethyl-N-(2-methylprop-2-enyl)pentanamide (CID 107568096) is (2R)-2-amino-N-ethyl-N-(2-methylprop-2-enyl)pentanamide.
What is the SMILES notation for (2R)-2-amino-N-ethyl-N-(2-methylprop-2-enyl)pentanamide?
The canonical SMILES for (2R)-2-amino-N-ethyl-N-(2-methylprop-2-enyl)pentanamide is C=C(C)CN(CC)C(=O)[C@H](N)CCC.
What is the InChIKey of (2R)-2-amino-N-ethyl-N-(2-methylprop-2-enyl)pentanamide?
The InChIKey is FDYSWUPONQBSIR-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H22N2O/c1-5-7-10(12)11(14)13(6-2)8-9(3)4/h10H,3,5-8,12H2,1-2,4H3/t10-/m1/s1.
What are the key properties of (2R)-2-amino-N-ethyl-N-(2-methylprop-2-enyl)pentanamide?
(2R)-2-amino-N-ethyl-N-(2-methylprop-2-enyl)pentanamide has a molecular weight of 198.31 g/mol, XLogP of 1.54, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-ethyl-N-(2-methylprop-2-enyl)pentanamide is sourced from PubChem (CID 107568096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).