N-[(1R)-1-(4-pyrazolo[1,5-a]pyridin-3-ylphenyl)ethyl]prop-2-enamide

C18H17N3O — CID 172887533

IUPACN-[(1R)-1-(4-pyrazolo[1,5-a]pyridin-3-ylphenyl)ethyl]prop-2-enamide
SMILESC=CC(=O)N[C@H](C)c1ccc(-c2cnn3ccccc23)cc1
InChIInChI=1S/C18H17N3O/c1-3-18(22)20-13(2)14-7-9-15(10-8-14)16-12-19-21-11-5-4-6-17(16)21/h3-13H,1H2,2H3,(H,20,22)/t13-/m1/s1
InChIKeyAQLAZADDVNYQSH-CYBMUJFWSA-N
MW291.35 g/mol
LogP3.36
Rot. Bonds4

About N-[(1R)-1-(4-pyrazolo[1,5-a]pyridin-3-ylphenyl)ethyl]prop-2-enamide

N-[(1R)-1-(4-pyrazolo[1,5-a]pyridin-3-ylphenyl)ethyl]prop-2-enamide (PubChem CID 172887533) has the molecular formula C18H17N3O and a molecular weight of 291.35 g/mol. Its IUPAC name is N-[(1R)-1-(4-pyrazolo[1,5-a]pyridin-3-ylphenyl)ethyl]prop-2-enamide.

Molecular Properties

Compound NameN-[(1R)-1-(4-pyrazolo[1,5-a]pyridin-3-ylphenyl)ethyl]prop-2-enamide
PubChem CID172887533
Molecular FormulaC18H17N3O
Molecular Weight291.35 g/mol
Exact Mass291.14
IUPAC NameN-[(1R)-1-(4-pyrazolo[1,5-a]pyridin-3-ylphenyl)ethyl]prop-2-enamide
SMILESC=CC(=O)N[C@H](C)c1ccc(-c2cnn3ccccc23)cc1
InChIInChI=1S/C18H17N3O/c1-3-18(22)20-13(2)14-7-9-15(10-8-14)16-12-19-21-11-5-4-6-17(16)21/h3-13H,1H2,2H3,(H,20,22)/t13-/m1/s1
InChIKeyAQLAZADDVNYQSH-CYBMUJFWSA-N
XLogP3.36
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

N-[(1R)-1-[4-(1H-indazol-7-yl)phenyl]ethyl]prop-2-enamide
CID 172887522
N-[1-(1-methylindazol-5-yl)ethyl]prop-2-enamide
CID 166428635
N-methoxy-N-methyl-4-pyrazolo[1,5-a]pyridin-3-ylbenzamide
CID 171682360
N-[(1S)-1-naphthalen-2-ylethyl]prop-2-enamide
CID 101382734
N-(3-pyrazolo[1,5-a]pyridin-3-ylphenyl)acetamide
CID 66592668
N-[(1S)-1-(furan-3-yl)ethyl]prop-2-enamide
CID 166410284
2-pyrazolo[1,5-a]pyridin-3-ylfluoren-9-one
CID 170173540
N-[(1R)-1-(4-phenylphenyl)ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 52534736
morpholin-4-yl-(4-pyrazolo[1,5-a]pyridin-3-ylphenyl)methanone
CID 144901391
N-[(1S)-1-(3,5-difluorophenyl)ethyl]prop-2-enamide
CID 167781770
N-[1-[1-(2-methylpropyl)benzimidazol-2-yl]ethyl]prop-2-enamide
CID 16969940
N-[(1S)-1-[4-(trifluoromethoxy)phenyl]ethyl]prop-2-enamide
CID 166408095

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(4-pyrazolo[1,5-a]pyridin-3-ylphenyl)ethyl]prop-2-enamide?
The IUPAC name of N-[(1R)-1-(4-pyrazolo[1,5-a]pyridin-3-ylphenyl)ethyl]prop-2-enamide (CID 172887533) is N-[(1R)-1-(4-pyrazolo[1,5-a]pyridin-3-ylphenyl)ethyl]prop-2-enamide.
What is the SMILES notation for N-[(1R)-1-(4-pyrazolo[1,5-a]pyridin-3-ylphenyl)ethyl]prop-2-enamide?
The canonical SMILES for N-[(1R)-1-(4-pyrazolo[1,5-a]pyridin-3-ylphenyl)ethyl]prop-2-enamide is C=CC(=O)N[C@H](C)c1ccc(-c2cnn3ccccc23)cc1.
What is the InChIKey of N-[(1R)-1-(4-pyrazolo[1,5-a]pyridin-3-ylphenyl)ethyl]prop-2-enamide?
The InChIKey is AQLAZADDVNYQSH-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H17N3O/c1-3-18(22)20-13(2)14-7-9-15(10-8-14)16-12-19-21-11-5-4-6-17(16)21/h3-13H,1H2,2H3,(H,20,22)/t13-/m1/s1.
What are the key properties of N-[(1R)-1-(4-pyrazolo[1,5-a]pyridin-3-ylphenyl)ethyl]prop-2-enamide?
N-[(1R)-1-(4-pyrazolo[1,5-a]pyridin-3-ylphenyl)ethyl]prop-2-enamide has a molecular weight of 291.35 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(4-pyrazolo[1,5-a]pyridin-3-ylphenyl)ethyl]prop-2-enamide is sourced from PubChem (CID 172887533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).