6-amino-N-(3,3-diphenylpropyl)pyridine-3-carboxamide

C21H21N3O — CID 11976309

IUPAC6-amino-N-(3,3-diphenylpropyl)pyridine-3-carboxamide
SMILESNc1ccc(C(=O)NCCC(c2ccccc2)c2ccccc2)cn1
InChIInChI=1S/C21H21N3O/c22-20-12-11-18(15-24-20)21(25)23-14-13-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-12,15,19H,13-14H2,(H2,22,24)(H,23,25)
InChIKeyDZGHCDWBFODWBC-UHFFFAOYSA-N
MW331.42 g/mol
LogP3.62
Rot. Bonds6

About 6-amino-N-(3,3-diphenylpropyl)pyridine-3-carboxamide

6-amino-N-(3,3-diphenylpropyl)pyridine-3-carboxamide (PubChem CID 11976309) has the molecular formula C21H21N3O and a molecular weight of 331.42 g/mol. Its IUPAC name is 6-amino-N-(3,3-diphenylpropyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-(3,3-diphenylpropyl)pyridine-3-carboxamide
PubChem CID11976309
Molecular FormulaC21H21N3O
Molecular Weight331.42 g/mol
Exact Mass331.17
IUPAC Name6-amino-N-(3,3-diphenylpropyl)pyridine-3-carboxamide
SMILESNc1ccc(C(=O)NCCC(c2ccccc2)c2ccccc2)cn1
InChIInChI=1S/C21H21N3O/c22-20-12-11-18(15-24-20)21(25)23-14-13-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-12,15,19H,13-14H2,(H2,22,24)(H,23,25)
InChIKeyDZGHCDWBFODWBC-UHFFFAOYSA-N
XLogP3.62
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(3,3-diphenylpropyl)pyridine-3-carboxamide?
The IUPAC name of 6-amino-N-(3,3-diphenylpropyl)pyridine-3-carboxamide (CID 11976309) is 6-amino-N-(3,3-diphenylpropyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-amino-N-(3,3-diphenylpropyl)pyridine-3-carboxamide?
The canonical SMILES for 6-amino-N-(3,3-diphenylpropyl)pyridine-3-carboxamide is Nc1ccc(C(=O)NCCC(c2ccccc2)c2ccccc2)cn1.
What is the InChIKey of 6-amino-N-(3,3-diphenylpropyl)pyridine-3-carboxamide?
The InChIKey is DZGHCDWBFODWBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O/c22-20-12-11-18(15-24-20)21(25)23-14-13-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-12,15,19H,13-14H2,(H2,22,24)(H,23,25).
What are the key properties of 6-amino-N-(3,3-diphenylpropyl)pyridine-3-carboxamide?
6-amino-N-(3,3-diphenylpropyl)pyridine-3-carboxamide has a molecular weight of 331.42 g/mol, XLogP of 3.62, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(3,3-diphenylpropyl)pyridine-3-carboxamide is sourced from PubChem (CID 11976309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).