N-[[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]methyl]pyridine-4-carboxamide

C16H19N3O2 — CID 86783842

IUPACN-[[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]methyl]pyridine-4-carboxamide
SMILESCC(C)(C)Oc1ccc(CNC(=O)c2ccncc2)cn1
InChIInChI=1S/C16H19N3O2/c1-16(2,3)21-14-5-4-12(10-18-14)11-19-15(20)13-6-8-17-9-7-13/h4-10H,11H2,1-3H3,(H,19,20)
InChIKeyFANDPDQEWZNJAX-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.58
Rot. Bonds4

About N-[[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]methyl]pyridine-4-carboxamide

N-[[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]methyl]pyridine-4-carboxamide (PubChem CID 86783842) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N-[[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]methyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]methyl]pyridine-4-carboxamide
PubChem CID86783842
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC NameN-[[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]methyl]pyridine-4-carboxamide
SMILESCC(C)(C)Oc1ccc(CNC(=O)c2ccncc2)cn1
InChIInChI=1S/C16H19N3O2/c1-16(2,3)21-14-5-4-12(10-18-14)11-19-15(20)13-6-8-17-9-7-13/h4-10H,11H2,1-3H3,(H,19,20)
InChIKeyFANDPDQEWZNJAX-UHFFFAOYSA-N
XLogP2.58
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]methyl]pyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-N,4-N-bis[(6-methoxy-3-pyridinyl)methyl]benzene-1,4-dicarboxamide
CID 24646071
1-[[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]methyl]-3-(pyridin-2-ylmethyl)urea
CID 75517689
4-(ethylamino)-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
CID 62991496
N-[[6-(dimethylsulfamoylamino)-3-pyridinyl]methyl]pyridine-4-carboxamide
CID 140582769
2-(1-hydroxycyclohexyl)-N-[[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]methyl]acetamide
CID 110010126
N-[(2-methoxy-4-pyridinyl)methyl]pyridine-4-carboxamide
CID 47142420
N-[(6-methoxy-3-pyridinyl)methyl]-4-phenylbenzamide
CID 24589971
2-(aminomethyl)-N-[(6-methoxy-3-pyridinyl)methyl]pyridine-4-carboxamide
CID 114326282
N-[[4-(bromomethyl)phenyl]methyl]pyridine-4-carboxamide
CID 107233792
N-(1H-pyrazol-4-ylmethyl)pyridine-4-carboxamide
CID 60755457
N-(2-hydroxy-3,3-dimethylbutyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide
CID 110000209
N-[(6-methoxy-3-pyridinyl)methyl]pyrazine-2-carboxamide
CID 51306029

Frequently Asked Questions

What is the IUPAC name of N-[[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]methyl]pyridine-4-carboxamide?
The IUPAC name of N-[[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]methyl]pyridine-4-carboxamide (CID 86783842) is N-[[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]methyl]pyridine-4-carboxamide.
What is the SMILES notation for N-[[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]methyl]pyridine-4-carboxamide?
The canonical SMILES for N-[[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]methyl]pyridine-4-carboxamide is CC(C)(C)Oc1ccc(CNC(=O)c2ccncc2)cn1.
What is the InChIKey of N-[[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]methyl]pyridine-4-carboxamide?
The InChIKey is FANDPDQEWZNJAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-16(2,3)21-14-5-4-12(10-18-14)11-19-15(20)13-6-8-17-9-7-13/h4-10H,11H2,1-3H3,(H,19,20).
What are the key properties of N-[[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]methyl]pyridine-4-carboxamide?
N-[[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]methyl]pyridine-4-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 2.58, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]methyl]pyridine-4-carboxamide is sourced from PubChem (CID 86783842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).