2-[[6-methyl-2-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]propanamide

C14H23N3O2 — CID 79158480

IUPAC2-[[6-methyl-2-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]propanamide
SMILESCc1ccc(OC(C)C(N)=O)c(CNCC(C)C)n1
InChIInChI=1S/C14H23N3O2/c1-9(2)7-16-8-12-13(6-5-10(3)17-12)19-11(4)14(15)18/h5-6,9,11,16H,7-8H2,1-4H3,(H2,15,18)
InChIKeyQSGGEBMJQZEKJB-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.39
Rot. Bonds7

About 2-[[6-methyl-2-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]propanamide

2-[[6-methyl-2-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]propanamide (PubChem CID 79158480) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-[[6-methyl-2-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]propanamide.

Molecular Properties

Compound Name2-[[6-methyl-2-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]propanamide
PubChem CID79158480
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name2-[[6-methyl-2-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]propanamide
SMILESCc1ccc(OC(C)C(N)=O)c(CNCC(C)C)n1
InChIInChI=1S/C14H23N3O2/c1-9(2)7-16-8-12-13(6-5-10(3)17-12)19-11(4)14(15)18/h5-6,9,11,16H,7-8H2,1-4H3,(H2,15,18)
InChIKeyQSGGEBMJQZEKJB-UHFFFAOYSA-N
XLogP1.39
TPSA77.24 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 ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[6-methyl-2-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]propanoic acid
CID 79157379
2-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]-N-(2-methylpropyl)propanamide
CID 79157517
methyl 2-[[6-methyl-2-(propylaminomethyl)-3-pyridinyl]oxy]propanoate
CID 79151146
N-ethyl-2-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]propanamide
CID 79151205
N-ethyl-2-[[6-methyl-2-(propylaminomethyl)-3-pyridinyl]oxy]propanamide
CID 79150446
N-butyl-2-[[2-(ethylaminomethyl)-6-methyl-3-pyridinyl]oxy]propanamide
CID 79157524
N-[[3-(methoxymethoxy)-6-methyl-2-pyridinyl]methyl]-2-methylpropan-1-amine
CID 79156612
N-[[3-(3-fluoropropoxy)-6-methyl-2-pyridinyl]methyl]-2-methylpropan-1-amine
CID 81106538
2-[4-bromo-2-[(2-methylpropylamino)methyl]phenoxy]propanamide
CID 63057512
2-[[6-methyl-2-(propylaminomethyl)-3-pyridinyl]oxy]-N-prop-2-ynylpropanamide
CID 79157729
ethyl 2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]propanoate
CID 79169271
N-[[3-(cyclopropylmethoxy)-6-methyl-2-pyridinyl]methyl]-2-methylpropan-1-amine
CID 79159102

Frequently Asked Questions

What is the IUPAC name of 2-[[6-methyl-2-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]propanamide?
The IUPAC name of 2-[[6-methyl-2-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]propanamide (CID 79158480) is 2-[[6-methyl-2-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]propanamide.
What is the SMILES notation for 2-[[6-methyl-2-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]propanamide?
The canonical SMILES for 2-[[6-methyl-2-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]propanamide is Cc1ccc(OC(C)C(N)=O)c(CNCC(C)C)n1.
What is the InChIKey of 2-[[6-methyl-2-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]propanamide?
The InChIKey is QSGGEBMJQZEKJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-9(2)7-16-8-12-13(6-5-10(3)17-12)19-11(4)14(15)18/h5-6,9,11,16H,7-8H2,1-4H3,(H2,15,18).
What are the key properties of 2-[[6-methyl-2-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]propanamide?
2-[[6-methyl-2-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]propanamide has a molecular weight of 265.36 g/mol, XLogP of 1.39, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-methyl-2-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]propanamide is sourced from PubChem (CID 79158480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).