2-amino-N-[(3-ethyl-2-pyridinyl)methyl]-3-methoxypropanamide

C12H19N3O2 — CID 82738332

IUPAC2-amino-N-[(3-ethyl-2-pyridinyl)methyl]-3-methoxypropanamide
SMILESCCc1cccnc1CNC(=O)C(N)COC
InChIInChI=1S/C12H19N3O2/c1-3-9-5-4-6-14-11(9)7-15-12(16)10(13)8-17-2/h4-6,10H,3,7-8,13H2,1-2H3,(H,15,16)
InChIKeyDDDHHOQDNJFWQY-UHFFFAOYSA-N
MW237.30 g/mol
LogP0.23
Rot. Bonds6

About 2-amino-N-[(3-ethyl-2-pyridinyl)methyl]-3-methoxypropanamide

2-amino-N-[(3-ethyl-2-pyridinyl)methyl]-3-methoxypropanamide (PubChem CID 82738332) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is 2-amino-N-[(3-ethyl-2-pyridinyl)methyl]-3-methoxypropanamide.

Molecular Properties

Compound Name2-amino-N-[(3-ethyl-2-pyridinyl)methyl]-3-methoxypropanamide
PubChem CID82738332
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC Name2-amino-N-[(3-ethyl-2-pyridinyl)methyl]-3-methoxypropanamide
SMILESCCc1cccnc1CNC(=O)C(N)COC
InChIInChI=1S/C12H19N3O2/c1-3-9-5-4-6-14-11(9)7-15-12(16)10(13)8-17-2/h4-6,10H,3,7-8,13H2,1-2H3,(H,15,16)
InChIKeyDDDHHOQDNJFWQY-UHFFFAOYSA-N
XLogP0.23
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-3-methoxy-N-(quinolin-8-ylmethyl)propanamide
CID 81428067
3-amino-N-[(3-ethyl-2-pyridinyl)methyl]butanamide
CID 82738689
2-hydroxyethyl N-[(3-ethyl-2-pyridinyl)methyl]carbamate
CID 82744779
2-amino-N-[[2-(2-hydroxyethoxy)phenyl]methyl]-3-methoxypropanamide;hydrochloride
CID 120992179
2-cyano-N-[(3-ethyl-2-pyridinyl)methyl]propanamide
CID 82737778
3-amino-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide
CID 104742770
N-[(3-ethyl-2-pyridinyl)methyl]-1-methoxybutan-2-amine
CID 82732422
2-[2-[[(2-amino-3-methoxypropanoyl)amino]methyl]phenyl]acetic acid
CID 81317772
2-[(3-ethyl-2-pyridinyl)methylcarbamoylamino]-4-methoxybutanoic acid
CID 82731415
2-amino-3-methoxy-N-[[2-(propoxymethyl)phenyl]methyl]propanamide;hydrochloride
CID 120986491
2-amino-N-[(4-ethoxyphenyl)methyl]-3-methoxypropanamide
CID 120985316
2-amino-3-methoxy-N-[(2-pyrazol-1-ylphenyl)methyl]propanamide
CID 81089680

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(3-ethyl-2-pyridinyl)methyl]-3-methoxypropanamide?
The IUPAC name of 2-amino-N-[(3-ethyl-2-pyridinyl)methyl]-3-methoxypropanamide (CID 82738332) is 2-amino-N-[(3-ethyl-2-pyridinyl)methyl]-3-methoxypropanamide.
What is the SMILES notation for 2-amino-N-[(3-ethyl-2-pyridinyl)methyl]-3-methoxypropanamide?
The canonical SMILES for 2-amino-N-[(3-ethyl-2-pyridinyl)methyl]-3-methoxypropanamide is CCc1cccnc1CNC(=O)C(N)COC.
What is the InChIKey of 2-amino-N-[(3-ethyl-2-pyridinyl)methyl]-3-methoxypropanamide?
The InChIKey is DDDHHOQDNJFWQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-3-9-5-4-6-14-11(9)7-15-12(16)10(13)8-17-2/h4-6,10H,3,7-8,13H2,1-2H3,(H,15,16).
What are the key properties of 2-amino-N-[(3-ethyl-2-pyridinyl)methyl]-3-methoxypropanamide?
2-amino-N-[(3-ethyl-2-pyridinyl)methyl]-3-methoxypropanamide has a molecular weight of 237.30 g/mol, XLogP of 0.23, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(3-ethyl-2-pyridinyl)methyl]-3-methoxypropanamide is sourced from PubChem (CID 82738332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).