(2R)-2-amino-N-(1-methoxybutan-2-yl)-3-methylbutanamide

C10H22N2O2 — CID 79012417

IUPAC(2R)-2-amino-N-(1-methoxybutan-2-yl)-3-methylbutanamide
SMILESCCC(COC)NC(=O)[C@H](N)C(C)C
InChIInChI=1S/C10H22N2O2/c1-5-8(6-14-4)12-10(13)9(11)7(2)3/h7-9H,5-6,11H2,1-4H3,(H,12,13)/t8?,9-/m1/s1
InChIKeyHABAVJAIZKJGII-YGPZHTELSA-N
MW202.30 g/mol
LogP0.51
Rot. Bonds6

About (2R)-2-amino-N-(1-methoxybutan-2-yl)-3-methylbutanamide

(2R)-2-amino-N-(1-methoxybutan-2-yl)-3-methylbutanamide (PubChem CID 79012417) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is (2R)-2-amino-N-(1-methoxybutan-2-yl)-3-methylbutanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(1-methoxybutan-2-yl)-3-methylbutanamide
PubChem CID79012417
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name(2R)-2-amino-N-(1-methoxybutan-2-yl)-3-methylbutanamide
SMILESCCC(COC)NC(=O)[C@H](N)C(C)C
InChIInChI=1S/C10H22N2O2/c1-5-8(6-14-4)12-10(13)9(11)7(2)3/h7-9H,5-6,11H2,1-4H3,(H,12,13)/t8?,9-/m1/s1
InChIKeyHABAVJAIZKJGII-YGPZHTELSA-N
XLogP0.51
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-[2-(1-methoxybutan-2-ylamino)-2-oxoethyl]-3-methylbutanamide
CID 82961919
(2S)-2-[(2-amino-3-methylbutanoyl)amino]-3-methylpentanoic acid
CID 61174009
N-[(2R)-1-methoxybutan-2-yl]acetamide
CID 118873564
N-(1-methoxybutan-2-yl)propanamide
CID 64590697
(2S)-2-amino-N-(1-methoxybutan-2-yl)-2-phenylacetamide
CID 104897960
(2R)-2-amino-N-(1-hydroxy-3-methoxypropan-2-yl)butanamide
CID 106188743
3-amino-N-(1-methoxybutan-2-yl)-2-methyl-3-phenylpropanamide;hydrochloride
CID 119706806
(2S)-2-amino-N-[(2S)-1-hydroxybutan-2-yl]-3-methylpentanamide
CID 107222401
(2S)-2-amino-N-(1-methoxypentan-2-yl)butanamide
CID 79023147
(3R,4R,5R)-3-[[(2S)-2-amino-3-methylbutanoyl]amino]-4,5-dimethylheptanoic acid
CID 87610116
2-[(1-methoxy-3-methylbutan-2-yl)amino]-N-pentan-3-ylpropanamide
CID 65049236
(2R)-2-amino-N-(2-hydroxy-3-methoxypropyl)-3-methylbutanamide
CID 79012762

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(1-methoxybutan-2-yl)-3-methylbutanamide?
The IUPAC name of (2R)-2-amino-N-(1-methoxybutan-2-yl)-3-methylbutanamide (CID 79012417) is (2R)-2-amino-N-(1-methoxybutan-2-yl)-3-methylbutanamide.
What is the SMILES notation for (2R)-2-amino-N-(1-methoxybutan-2-yl)-3-methylbutanamide?
The canonical SMILES for (2R)-2-amino-N-(1-methoxybutan-2-yl)-3-methylbutanamide is CCC(COC)NC(=O)[C@H](N)C(C)C.
What is the InChIKey of (2R)-2-amino-N-(1-methoxybutan-2-yl)-3-methylbutanamide?
The InChIKey is HABAVJAIZKJGII-YGPZHTELSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-5-8(6-14-4)12-10(13)9(11)7(2)3/h7-9H,5-6,11H2,1-4H3,(H,12,13)/t8?,9-/m1/s1.
What are the key properties of (2R)-2-amino-N-(1-methoxybutan-2-yl)-3-methylbutanamide?
(2R)-2-amino-N-(1-methoxybutan-2-yl)-3-methylbutanamide has a molecular weight of 202.30 g/mol, XLogP of 0.51, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(1-methoxybutan-2-yl)-3-methylbutanamide is sourced from PubChem (CID 79012417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).