(2R)-2-amino-N-(2-hydroxyethyl)-3-methyl-N-propylbutanamide

C10H22N2O2 — CID 79012704

IUPAC(2R)-2-amino-N-(2-hydroxyethyl)-3-methyl-N-propylbutanamide
SMILESCCCN(CCO)C(=O)[C@H](N)C(C)C
InChIInChI=1S/C10H22N2O2/c1-4-5-12(6-7-13)10(14)9(11)8(2)3/h8-9,13H,4-7,11H2,1-3H3/t9-/m1/s1
InChIKeyYMTGXAJKQDOQQY-SECBINFHSA-N
MW202.30 g/mol
LogP0.20
Rot. Bonds6

About (2R)-2-amino-N-(2-hydroxyethyl)-3-methyl-N-propylbutanamide

(2R)-2-amino-N-(2-hydroxyethyl)-3-methyl-N-propylbutanamide (PubChem CID 79012704) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is (2R)-2-amino-N-(2-hydroxyethyl)-3-methyl-N-propylbutanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(2-hydroxyethyl)-3-methyl-N-propylbutanamide
PubChem CID79012704
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name(2R)-2-amino-N-(2-hydroxyethyl)-3-methyl-N-propylbutanamide
SMILESCCCN(CCO)C(=O)[C@H](N)C(C)C
InChIInChI=1S/C10H22N2O2/c1-4-5-12(6-7-13)10(14)9(11)8(2)3/h8-9,13H,4-7,11H2,1-3H3/t9-/m1/s1
InChIKeyYMTGXAJKQDOQQY-SECBINFHSA-N
XLogP0.20
TPSA66.56 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 ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(2-hydroxyethyl)-3-methyl-N-propylbutanamide?
The IUPAC name of (2R)-2-amino-N-(2-hydroxyethyl)-3-methyl-N-propylbutanamide (CID 79012704) is (2R)-2-amino-N-(2-hydroxyethyl)-3-methyl-N-propylbutanamide.
What is the SMILES notation for (2R)-2-amino-N-(2-hydroxyethyl)-3-methyl-N-propylbutanamide?
The canonical SMILES for (2R)-2-amino-N-(2-hydroxyethyl)-3-methyl-N-propylbutanamide is CCCN(CCO)C(=O)[C@H](N)C(C)C.
What is the InChIKey of (2R)-2-amino-N-(2-hydroxyethyl)-3-methyl-N-propylbutanamide?
The InChIKey is YMTGXAJKQDOQQY-SECBINFHSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-4-5-12(6-7-13)10(14)9(11)8(2)3/h8-9,13H,4-7,11H2,1-3H3/t9-/m1/s1.
What are the key properties of (2R)-2-amino-N-(2-hydroxyethyl)-3-methyl-N-propylbutanamide?
(2R)-2-amino-N-(2-hydroxyethyl)-3-methyl-N-propylbutanamide has a molecular weight of 202.30 g/mol, XLogP of 0.20, 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-(2-hydroxyethyl)-3-methyl-N-propylbutanamide is sourced from PubChem (CID 79012704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).