2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]acetamide

C10H15N3O — CID 96555130

IUPAC2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]acetamide
SMILESC[C@@H](c1ccccn1)N(C)C(=O)CN
InChIInChI=1S/C10H15N3O/c1-8(13(2)10(14)7-11)9-5-3-4-6-12-9/h3-6,8H,7,11H2,1-2H3/t8-/m0/s1
InChIKeyYEPWPRRFGHWWQZ-QMMMGPOBSA-N
MW193.25 g/mol
LogP0.56
Rot. Bonds3

About 2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]acetamide

2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]acetamide (PubChem CID 96555130) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]acetamide.

Molecular Properties

Compound Name2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]acetamide
PubChem CID96555130
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]acetamide
SMILESC[C@@H](c1ccccn1)N(C)C(=O)CN
InChIInChI=1S/C10H15N3O/c1-8(13(2)10(14)7-11)9-5-3-4-6-12-9/h3-6,8H,7,11H2,1-2H3/t8-/m0/s1
InChIKeyYEPWPRRFGHWWQZ-QMMMGPOBSA-N
XLogP0.56
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]acetamide?
The IUPAC name of 2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]acetamide (CID 96555130) is 2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]acetamide.
What is the SMILES notation for 2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]acetamide?
The canonical SMILES for 2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]acetamide is C[C@@H](c1ccccn1)N(C)C(=O)CN.
What is the InChIKey of 2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]acetamide?
The InChIKey is YEPWPRRFGHWWQZ-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H15N3O/c1-8(13(2)10(14)7-11)9-5-3-4-6-12-9/h3-6,8H,7,11H2,1-2H3/t8-/m0/s1.
What are the key properties of 2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]acetamide?
2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]acetamide has a molecular weight of 193.25 g/mol, XLogP of 0.56, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-N-[(1S)-1-pyridin-2-ylethyl]acetamide is sourced from PubChem (CID 96555130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).