6-[4-(1-amino-2,2-dimethyl-3-phenylpropyl)phenoxy]pyridine-3-carboxamide

C23H25N3O2 — CID 174444882

IUPAC6-[4-(1-amino-2,2-dimethyl-3-phenylpropyl)phenoxy]pyridine-3-carboxamide
SMILESCC(C)(Cc1ccccc1)C(N)c1ccc(Oc2ccc(C(N)=O)cn2)cc1
InChIInChI=1S/C23H25N3O2/c1-23(2,14-16-6-4-3-5-7-16)21(24)17-8-11-19(12-9-17)28-20-13-10-18(15-26-20)22(25)27/h3-13,15,21H,14,24H2,1-2H3,(H2,25,27)
InChIKeyZSFZMEOJDJNYHX-UHFFFAOYSA-N
MW375.47 g/mol
LogP4.24
Rot. Bonds7

About 6-[4-(1-amino-2,2-dimethyl-3-phenylpropyl)phenoxy]pyridine-3-carboxamide

6-[4-(1-amino-2,2-dimethyl-3-phenylpropyl)phenoxy]pyridine-3-carboxamide (PubChem CID 174444882) has the molecular formula C23H25N3O2 and a molecular weight of 375.47 g/mol. Its IUPAC name is 6-[4-(1-amino-2,2-dimethyl-3-phenylpropyl)phenoxy]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[4-(1-amino-2,2-dimethyl-3-phenylpropyl)phenoxy]pyridine-3-carboxamide
PubChem CID174444882
Molecular FormulaC23H25N3O2
Molecular Weight375.47 g/mol
Exact Mass375.19
IUPAC Name6-[4-(1-amino-2,2-dimethyl-3-phenylpropyl)phenoxy]pyridine-3-carboxamide
SMILESCC(C)(Cc1ccccc1)C(N)c1ccc(Oc2ccc(C(N)=O)cn2)cc1
InChIInChI=1S/C23H25N3O2/c1-23(2,14-16-6-4-3-5-7-16)21(24)17-8-11-19(12-9-17)28-20-13-10-18(15-26-20)22(25)27/h3-13,15,21H,14,24H2,1-2H3,(H2,25,27)
InChIKeyZSFZMEOJDJNYHX-UHFFFAOYSA-N
XLogP4.24
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 54.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-[4-(1-amino-2,2-dimethyl-3-phenylpropyl)phenoxy]pyridine-3-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

6-[4-[2-methyl-2-(2-phenylethylamino)propyl]phenoxy]pyridine-3-carboxamide
CID 68746672
6-[4-[1-(benzylamino)-2-methylpropan-2-yl]phenoxy]pyridine-3-carboxamide
CID 59729915
6-[4-(1-aminopropyl)phenoxy]pyridine-3-carboxamide
CID 174444828
6-(4-ethylphenoxy)pyridine-3-carboxamide
CID 91553748
6-[4-[(2R)-2-aminopropyl]phenoxy]pyridine-3-carboxamide;hydrochloride
CID 22087128
6-[4-(2-oxopropyl)phenoxy]pyridine-3-carboxamide
CID 22087205
6-[4-[3-(2-phenylethylamino)propyl]phenoxy]pyridine-3-carboxamide
CID 68748065
6-(4-hydroxyphenoxy)pyridine-3-carboxamide
CID 60868756
6-[4-(3-amino-2-methylpropyl)phenoxy]pyridine-3-carboxamide
CID 174444884
6-[4-[[(4-methoxyphenyl)methylamino]methyl]phenoxy]pyridine-3-carboxamide
CID 68745018
6-(4-pentylphenoxy)pyridine-3-carboxamide
CID 142415252
6-[4-[1-(pentylamino)ethyl]phenoxy]pyridine-3-carboxamide
CID 68749693

Frequently Asked Questions

What is the IUPAC name of 6-[4-(1-amino-2,2-dimethyl-3-phenylpropyl)phenoxy]pyridine-3-carboxamide?
The IUPAC name of 6-[4-(1-amino-2,2-dimethyl-3-phenylpropyl)phenoxy]pyridine-3-carboxamide (CID 174444882) is 6-[4-(1-amino-2,2-dimethyl-3-phenylpropyl)phenoxy]pyridine-3-carboxamide.
What is the SMILES notation for 6-[4-(1-amino-2,2-dimethyl-3-phenylpropyl)phenoxy]pyridine-3-carboxamide?
The canonical SMILES for 6-[4-(1-amino-2,2-dimethyl-3-phenylpropyl)phenoxy]pyridine-3-carboxamide is CC(C)(Cc1ccccc1)C(N)c1ccc(Oc2ccc(C(N)=O)cn2)cc1.
What is the InChIKey of 6-[4-(1-amino-2,2-dimethyl-3-phenylpropyl)phenoxy]pyridine-3-carboxamide?
The InChIKey is ZSFZMEOJDJNYHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O2/c1-23(2,14-16-6-4-3-5-7-16)21(24)17-8-11-19(12-9-17)28-20-13-10-18(15-26-20)22(25)27/h3-13,15,21H,14,24H2,1-2H3,(H2,25,27).
What are the key properties of 6-[4-(1-amino-2,2-dimethyl-3-phenylpropyl)phenoxy]pyridine-3-carboxamide?
6-[4-(1-amino-2,2-dimethyl-3-phenylpropyl)phenoxy]pyridine-3-carboxamide has a molecular weight of 375.47 g/mol, XLogP of 4.24, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(1-amino-2,2-dimethyl-3-phenylpropyl)phenoxy]pyridine-3-carboxamide is sourced from PubChem (CID 174444882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).