4-(3-amino-2-pyridinyl)-N-methyl-N-[[(2S)-oxan-2-yl]methyl]benzamide

C19H23N3O2 — CID 126435144

IUPAC4-(3-amino-2-pyridinyl)-N-methyl-N-[[(2S)-oxan-2-yl]methyl]benzamide
SMILESCN(C[C@@H]1CCCCO1)C(=O)c1ccc(-c2ncccc2N)cc1
InChIInChI=1S/C19H23N3O2/c1-22(13-16-5-2-3-12-24-16)19(23)15-9-7-14(8-10-15)18-17(20)6-4-11-21-18/h4,6-11,16H,2-3,5,12-13,20H2,1H3/t16-/m0/s1
InChIKeyFPFOWSHMWVYCOY-INIZCTEOSA-N
MW325.41 g/mol
LogP2.97
Rot. Bonds4

About 4-(3-amino-2-pyridinyl)-N-methyl-N-[[(2S)-oxan-2-yl]methyl]benzamide

4-(3-amino-2-pyridinyl)-N-methyl-N-[[(2S)-oxan-2-yl]methyl]benzamide (PubChem CID 126435144) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 4-(3-amino-2-pyridinyl)-N-methyl-N-[[(2S)-oxan-2-yl]methyl]benzamide.

Molecular Properties

Compound Name4-(3-amino-2-pyridinyl)-N-methyl-N-[[(2S)-oxan-2-yl]methyl]benzamide
PubChem CID126435144
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name4-(3-amino-2-pyridinyl)-N-methyl-N-[[(2S)-oxan-2-yl]methyl]benzamide
SMILESCN(C[C@@H]1CCCCO1)C(=O)c1ccc(-c2ncccc2N)cc1
InChIInChI=1S/C19H23N3O2/c1-22(13-16-5-2-3-12-24-16)19(23)15-9-7-14(8-10-15)18-17(20)6-4-11-21-18/h4,6-11,16H,2-3,5,12-13,20H2,1H3/t16-/m0/s1
InChIKeyFPFOWSHMWVYCOY-INIZCTEOSA-N
XLogP2.97
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(3-amino-2-pyridinyl)-N-methyl-N-[[(2S)-oxan-2-yl]methyl]benzamide 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

4-amino-N-methyl-N-(oxan-2-ylmethyl)benzamide;hydrochloride
CID 119746333
4-amino-N-methyl-N-(oxolan-2-ylmethyl)benzamide;hydrochloride
CID 119708774
N-methyl-N-[[(2S)-oxan-2-yl]methyl]-1,8-naphthyridine-2-carboxamide
CID 95189773
N-methyl-N-(oxolan-2-ylmethyl)pyridine-4-carboxamide
CID 110733149
N-methyl-N-[[(2S)-oxan-2-yl]methyl]-2-pyridin-2-ylpyrimidine-5-carboxamide
CID 95551213
2-amino-6-chloro-N-methyl-N-(oxan-2-ylmethyl)benzamide
CID 63660209
2-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-3-carboxamide
CID 62179768
4-hydroxy-N-methyl-N-(oxolan-2-ylmethyl)benzamide
CID 61436471
2-fluoro-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide
CID 61435800
5-amino-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide
CID 81315666
4-acetamido-N-methyl-N-(oxolan-2-ylmethyl)benzamide
CID 110745427
N-methyl-2-(methylamino)-N-(oxan-2-ylmethyl)benzamide
CID 61436480

Frequently Asked Questions

What is the IUPAC name of 4-(3-amino-2-pyridinyl)-N-methyl-N-[[(2S)-oxan-2-yl]methyl]benzamide?
The IUPAC name of 4-(3-amino-2-pyridinyl)-N-methyl-N-[[(2S)-oxan-2-yl]methyl]benzamide (CID 126435144) is 4-(3-amino-2-pyridinyl)-N-methyl-N-[[(2S)-oxan-2-yl]methyl]benzamide.
What is the SMILES notation for 4-(3-amino-2-pyridinyl)-N-methyl-N-[[(2S)-oxan-2-yl]methyl]benzamide?
The canonical SMILES for 4-(3-amino-2-pyridinyl)-N-methyl-N-[[(2S)-oxan-2-yl]methyl]benzamide is CN(C[C@@H]1CCCCO1)C(=O)c1ccc(-c2ncccc2N)cc1.
What is the InChIKey of 4-(3-amino-2-pyridinyl)-N-methyl-N-[[(2S)-oxan-2-yl]methyl]benzamide?
The InChIKey is FPFOWSHMWVYCOY-INIZCTEOSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-22(13-16-5-2-3-12-24-16)19(23)15-9-7-14(8-10-15)18-17(20)6-4-11-21-18/h4,6-11,16H,2-3,5,12-13,20H2,1H3/t16-/m0/s1.
What are the key properties of 4-(3-amino-2-pyridinyl)-N-methyl-N-[[(2S)-oxan-2-yl]methyl]benzamide?
4-(3-amino-2-pyridinyl)-N-methyl-N-[[(2S)-oxan-2-yl]methyl]benzamide has a molecular weight of 325.41 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-amino-2-pyridinyl)-N-methyl-N-[[(2S)-oxan-2-yl]methyl]benzamide is sourced from PubChem (CID 126435144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).