2-[(6-methoxy-3-pyridinyl)methylamino]-N-(3-methylbutan-2-yl)acetamide

C14H23N3O2 — CID 62990803

IUPAC2-[(6-methoxy-3-pyridinyl)methylamino]-N-(3-methylbutan-2-yl)acetamide
SMILESCOc1ccc(CNCC(=O)NC(C)C(C)C)cn1
InChIInChI=1S/C14H23N3O2/c1-10(2)11(3)17-13(18)9-15-7-12-5-6-14(19-4)16-8-12/h5-6,8,10-11,15H,7,9H2,1-4H3,(H,17,18)
InChIKeyCAKYAYFATAOXJA-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.34
Rot. Bonds7

About 2-[(6-methoxy-3-pyridinyl)methylamino]-N-(3-methylbutan-2-yl)acetamide

2-[(6-methoxy-3-pyridinyl)methylamino]-N-(3-methylbutan-2-yl)acetamide (PubChem CID 62990803) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-[(6-methoxy-3-pyridinyl)methylamino]-N-(3-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-[(6-methoxy-3-pyridinyl)methylamino]-N-(3-methylbutan-2-yl)acetamide
PubChem CID62990803
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name2-[(6-methoxy-3-pyridinyl)methylamino]-N-(3-methylbutan-2-yl)acetamide
SMILESCOc1ccc(CNCC(=O)NC(C)C(C)C)cn1
InChIInChI=1S/C14H23N3O2/c1-10(2)11(3)17-13(18)9-15-7-12-5-6-14(19-4)16-8-12/h5-6,8,10-11,15H,7,9H2,1-4H3,(H,17,18)
InChIKeyCAKYAYFATAOXJA-UHFFFAOYSA-N
XLogP1.34
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-2-[(6-methoxy-3-pyridinyl)methylamino]acetamide
CID 62990480
propan-2-yl 2-[(6-methoxy-3-pyridinyl)methylamino]acetate
CID 62990974
N-(4-bromophenyl)-2-[(6-methoxy-3-pyridinyl)methylamino]acetamide
CID 62989750
(2R)-1-[(6-methoxy-3-pyridinyl)methylamino]propan-2-ol
CID 105014317
N-(2-bromophenyl)-2-[(6-methoxy-3-pyridinyl)methylamino]acetamide
CID 62989583
2-[(6-methoxy-3-pyridinyl)methylamino]-N-(oxan-4-yl)acetamide
CID 63097814
tert-butyl N-[1-[(6-methoxy-3-pyridinyl)methylamino]-3-methylbutan-2-yl]carbamate
CID 105007225
N-(3-bromophenyl)-2-[(6-methoxy-3-pyridinyl)methylamino]acetamide
CID 62989587
N-[(6-methoxy-3-pyridinyl)methyl]-4-methylpentan-1-amine
CID 83156007
ethyl 2-[(6-methoxy-3-pyridinyl)methylamino]propanoate
CID 62989922
N-[(6-methoxy-3-pyridinyl)methyl]-3-methylbutan-1-amine
CID 28712170
2-[(6-methoxy-3-pyridinyl)methylamino]propanamide
CID 60711228

Frequently Asked Questions

What is the IUPAC name of 2-[(6-methoxy-3-pyridinyl)methylamino]-N-(3-methylbutan-2-yl)acetamide?
The IUPAC name of 2-[(6-methoxy-3-pyridinyl)methylamino]-N-(3-methylbutan-2-yl)acetamide (CID 62990803) is 2-[(6-methoxy-3-pyridinyl)methylamino]-N-(3-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-[(6-methoxy-3-pyridinyl)methylamino]-N-(3-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-[(6-methoxy-3-pyridinyl)methylamino]-N-(3-methylbutan-2-yl)acetamide is COc1ccc(CNCC(=O)NC(C)C(C)C)cn1.
What is the InChIKey of 2-[(6-methoxy-3-pyridinyl)methylamino]-N-(3-methylbutan-2-yl)acetamide?
The InChIKey is CAKYAYFATAOXJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-10(2)11(3)17-13(18)9-15-7-12-5-6-14(19-4)16-8-12/h5-6,8,10-11,15H,7,9H2,1-4H3,(H,17,18).
What are the key properties of 2-[(6-methoxy-3-pyridinyl)methylamino]-N-(3-methylbutan-2-yl)acetamide?
2-[(6-methoxy-3-pyridinyl)methylamino]-N-(3-methylbutan-2-yl)acetamide has a molecular weight of 265.36 g/mol, XLogP of 1.34, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-methoxy-3-pyridinyl)methylamino]-N-(3-methylbutan-2-yl)acetamide is sourced from PubChem (CID 62990803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).