(2S)-2-amino-N-(2-methoxyethyl)-N,4-dimethylpentanamide

C10H22N2O2 — CID 61159296

IUPAC(2S)-2-amino-N-(2-methoxyethyl)-N,4-dimethylpentanamide
SMILESCOCCN(C)C(=O)[C@@H](N)CC(C)C
InChIInChI=1S/C10H22N2O2/c1-8(2)7-9(11)10(13)12(3)5-6-14-4/h8-9H,5-7,11H2,1-4H3/t9-/m0/s1
InChIKeyVQSJUOWFFLITTF-VIFPVBQESA-N
MW202.30 g/mol
LogP0.46
Rot. Bonds6

About (2S)-2-amino-N-(2-methoxyethyl)-N,4-dimethylpentanamide

(2S)-2-amino-N-(2-methoxyethyl)-N,4-dimethylpentanamide (PubChem CID 61159296) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is (2S)-2-amino-N-(2-methoxyethyl)-N,4-dimethylpentanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(2-methoxyethyl)-N,4-dimethylpentanamide
PubChem CID61159296
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name(2S)-2-amino-N-(2-methoxyethyl)-N,4-dimethylpentanamide
SMILESCOCCN(C)C(=O)[C@@H](N)CC(C)C
InChIInChI=1S/C10H22N2O2/c1-8(2)7-9(11)10(13)12(3)5-6-14-4/h8-9H,5-7,11H2,1-4H3/t9-/m0/s1
InChIKeyVQSJUOWFFLITTF-VIFPVBQESA-N
XLogP0.46
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N,4-dimethyl-N-(2-propan-2-yloxyethyl)pentanamide
CID 104903767
(2R)-2-amino-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-4-methylpentanamide
CID 104904000
methyl 4-[[(2R)-2-amino-4-methylpentanoyl]-methylamino]butanoate
CID 93371964
methyl 2-[[(2R)-2-amino-4-methylpentanoyl]-methylamino]acetate
CID 104903114
(2R)-2-amino-N-(2-methoxyethyl)-4-methyl-N-prop-2-enylpentanamide
CID 103338814
(2S)-2-amino-N-[2-(3-methoxypropylamino)-2-oxoethyl]-N,4-dimethylpentanamide
CID 61163445
2-amino-N,4-dimethylpentanehydrazide
CID 116848873
2-amino-N,4-dimethyl-N-(2-methylsulfonylethyl)pentanamide
CID 79858881
2-amino-5-methoxy-N-(3-methoxypropyl)-N-methylpentanamide
CID 81088448
(2S)-2-amino-N-(2-amino-2-oxoethyl)-N,4-dimethylpentanamide
CID 61154178
4-[2-methoxyethyl(methyl)amino]-2,3-dimethyl-4-oxobutanoic acid
CID 103497960
2-amino-N-(3-methoxypropyl)-N-methylbutanamide
CID 63010217

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(2-methoxyethyl)-N,4-dimethylpentanamide?
The IUPAC name of (2S)-2-amino-N-(2-methoxyethyl)-N,4-dimethylpentanamide (CID 61159296) is (2S)-2-amino-N-(2-methoxyethyl)-N,4-dimethylpentanamide.
What is the SMILES notation for (2S)-2-amino-N-(2-methoxyethyl)-N,4-dimethylpentanamide?
The canonical SMILES for (2S)-2-amino-N-(2-methoxyethyl)-N,4-dimethylpentanamide is COCCN(C)C(=O)[C@@H](N)CC(C)C.
What is the InChIKey of (2S)-2-amino-N-(2-methoxyethyl)-N,4-dimethylpentanamide?
The InChIKey is VQSJUOWFFLITTF-VIFPVBQESA-N. The full InChI is InChI=1S/C10H22N2O2/c1-8(2)7-9(11)10(13)12(3)5-6-14-4/h8-9H,5-7,11H2,1-4H3/t9-/m0/s1.
What are the key properties of (2S)-2-amino-N-(2-methoxyethyl)-N,4-dimethylpentanamide?
(2S)-2-amino-N-(2-methoxyethyl)-N,4-dimethylpentanamide has a molecular weight of 202.30 g/mol, XLogP of 0.46, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-(2-methoxyethyl)-N,4-dimethylpentanamide is sourced from PubChem (CID 61159296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).