4-[[4-(propylamino)-2-pyridinyl]methoxy]benzamide

C16H19N3O2 — CID 79245655

IUPAC4-[[4-(propylamino)-2-pyridinyl]methoxy]benzamide
SMILESCCCNc1ccnc(COc2ccc(C(N)=O)cc2)c1
InChIInChI=1S/C16H19N3O2/c1-2-8-18-13-7-9-19-14(10-13)11-21-15-5-3-12(4-6-15)16(17)20/h3-7,9-10H,2,8,11H2,1H3,(H2,17,20)(H,18,19)
InChIKeyXLOQNWKAYQSRFK-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.58
Rot. Bonds7

About 4-[[4-(propylamino)-2-pyridinyl]methoxy]benzamide

4-[[4-(propylamino)-2-pyridinyl]methoxy]benzamide (PubChem CID 79245655) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 4-[[4-(propylamino)-2-pyridinyl]methoxy]benzamide.

Molecular Properties

Compound Name4-[[4-(propylamino)-2-pyridinyl]methoxy]benzamide
PubChem CID79245655
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name4-[[4-(propylamino)-2-pyridinyl]methoxy]benzamide
SMILESCCCNc1ccnc(COc2ccc(C(N)=O)cc2)c1
InChIInChI=1S/C16H19N3O2/c1-2-8-18-13-7-9-19-14(10-13)11-21-15-5-3-12(4-6-15)16(17)20/h3-7,9-10H,2,8,11H2,1H3,(H2,17,20)(H,18,19)
InChIKeyXLOQNWKAYQSRFK-UHFFFAOYSA-N
XLogP2.58
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(phenoxymethyl)-N-propylpyridin-4-amine
CID 79250988
2-[(4-methylsulfanylphenoxy)methyl]-N-propylpyridin-4-amine
CID 79260330
2-[(3,4-difluorophenoxy)methyl]-N-propylpyridin-4-amine
CID 79251517
4-[(4-chloro-2-pyridinyl)methoxy]benzamide
CID 79255855
2-[(3-fluorophenoxy)methyl]-N-propylpyridin-4-amine
CID 79251163
N-propyl-2-[(2,4,6-trimethylphenoxy)methyl]pyridin-4-amine
CID 79261906
[4-[[4-(ethylamino)-2-pyridinyl]methoxy]phenyl]methanol
CID 79260144
2-[(2,5-dimethylphenoxy)methyl]-N-propylpyridin-4-amine
CID 79250898
4-methyl-3-[[4-(propylamino)-2-pyridinyl]methoxy]benzonitrile
CID 107660604
N-ethyl-2-[(4-methylsulfanylphenoxy)methyl]pyridin-4-amine
CID 79260149
2-[(2-fluoro-5-methylphenoxy)methyl]-N-propylpyridin-4-amine
CID 79260153
2-[methyl-[[4-(propylamino)-2-pyridinyl]methyl]amino]ethanol
CID 79244315

Frequently Asked Questions

What is the IUPAC name of 4-[[4-(propylamino)-2-pyridinyl]methoxy]benzamide?
The IUPAC name of 4-[[4-(propylamino)-2-pyridinyl]methoxy]benzamide (CID 79245655) is 4-[[4-(propylamino)-2-pyridinyl]methoxy]benzamide.
What is the SMILES notation for 4-[[4-(propylamino)-2-pyridinyl]methoxy]benzamide?
The canonical SMILES for 4-[[4-(propylamino)-2-pyridinyl]methoxy]benzamide is CCCNc1ccnc(COc2ccc(C(N)=O)cc2)c1.
What is the InChIKey of 4-[[4-(propylamino)-2-pyridinyl]methoxy]benzamide?
The InChIKey is XLOQNWKAYQSRFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-2-8-18-13-7-9-19-14(10-13)11-21-15-5-3-12(4-6-15)16(17)20/h3-7,9-10H,2,8,11H2,1H3,(H2,17,20)(H,18,19).
What are the key properties of 4-[[4-(propylamino)-2-pyridinyl]methoxy]benzamide?
4-[[4-(propylamino)-2-pyridinyl]methoxy]benzamide has a molecular weight of 285.35 g/mol, XLogP of 2.58, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-(propylamino)-2-pyridinyl]methoxy]benzamide is sourced from PubChem (CID 79245655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).