2-amino-N-[3-(2-methoxy-4-pyridinyl)-1-methylpyrazol-5-yl]-3-phenylpropanamide

C19H21N5O2 — CID 67496511

IUPAC2-amino-N-[3-(2-methoxy-4-pyridinyl)-1-methylpyrazol-5-yl]-3-phenylpropanamide
SMILESCOc1cc(-c2cc(NC(=O)C(N)Cc3ccccc3)n(C)n2)ccn1
InChIInChI=1S/C19H21N5O2/c1-24-17(12-16(23-24)14-8-9-21-18(11-14)26-2)22-19(25)15(20)10-13-6-4-3-5-7-13/h3-9,11-12,15H,10,20H2,1-2H3,(H,22,25)
InChIKeyMTQPUXOTYVJYHO-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.00
Rot. Bonds6

About 2-amino-N-[3-(2-methoxy-4-pyridinyl)-1-methylpyrazol-5-yl]-3-phenylpropanamide

2-amino-N-[3-(2-methoxy-4-pyridinyl)-1-methylpyrazol-5-yl]-3-phenylpropanamide (PubChem CID 67496511) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is 2-amino-N-[3-(2-methoxy-4-pyridinyl)-1-methylpyrazol-5-yl]-3-phenylpropanamide.

Molecular Properties

Compound Name2-amino-N-[3-(2-methoxy-4-pyridinyl)-1-methylpyrazol-5-yl]-3-phenylpropanamide
PubChem CID67496511
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC Name2-amino-N-[3-(2-methoxy-4-pyridinyl)-1-methylpyrazol-5-yl]-3-phenylpropanamide
SMILESCOc1cc(-c2cc(NC(=O)C(N)Cc3ccccc3)n(C)n2)ccn1
InChIInChI=1S/C19H21N5O2/c1-24-17(12-16(23-24)14-8-9-21-18(11-14)26-2)22-19(25)15(20)10-13-6-4-3-5-7-13/h3-9,11-12,15H,10,20H2,1-2H3,(H,22,25)
InChIKeyMTQPUXOTYVJYHO-UHFFFAOYSA-N
XLogP2.00
TPSA95.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

ethyl 2-[[(2S)-1-[[3-(2-methoxy-4-pyridinyl)-1-methylpyrazol-5-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]acetate;dihydrochloride
CID 67496192
(2S)-2-amino-3-(4-fluorophenyl)-N-[1-methyl-3-(2-methyl-4-pyridinyl)pyrazol-5-yl]propanamide;2,2,2-trifluoroacetic acid
CID 131731689
tert-butyl N-[(2S)-4-[3-(2-methoxy-4-pyridinyl)-1-methylpyrazol-5-yl]-3-oxo-1-phenylbutan-2-yl]carbamate
CID 158998678
(2S)-2-amino-3-(3,4-difluorophenyl)-N-(1-methyl-3-pyridin-4-ylpyrazol-5-yl)propanamide
CID 67496533
methyl 2-[[1-[(1-methyl-3-pyridin-4-ylpyrazol-5-yl)amino]-1-oxo-3-phenylpropan-2-yl]amino]acetate;dihydrochloride
CID 118105411
ethyl (2R)-2-amino-3-(2-methoxy-4-pyridinyl)propanoate
CID 124559660
2-amino-3-phenyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 61252081
(2S)-2-amino-N-(1-methylimidazol-2-yl)-3-phenylpropanamide
CID 15837349
2-amino-N-[(2-methoxy-3-pyridinyl)methyl]-3-phenylpropanamide
CID 60857697
2-[[3-[(2-amino-3-phenylpropanoyl)amino]-5-(2-methyl-4-pyridinyl)-2-pyridinyl]oxy]acetic acid
CID 67497912
2-amino-N-[3-chloro-5-(2-methyl-4-pyridinyl)phenyl]-3-phenylpropanamide
CID 77303408
methyl (2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-3-methylbutanoate
CID 11771430

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[3-(2-methoxy-4-pyridinyl)-1-methylpyrazol-5-yl]-3-phenylpropanamide?
The IUPAC name of 2-amino-N-[3-(2-methoxy-4-pyridinyl)-1-methylpyrazol-5-yl]-3-phenylpropanamide (CID 67496511) is 2-amino-N-[3-(2-methoxy-4-pyridinyl)-1-methylpyrazol-5-yl]-3-phenylpropanamide.
What is the SMILES notation for 2-amino-N-[3-(2-methoxy-4-pyridinyl)-1-methylpyrazol-5-yl]-3-phenylpropanamide?
The canonical SMILES for 2-amino-N-[3-(2-methoxy-4-pyridinyl)-1-methylpyrazol-5-yl]-3-phenylpropanamide is COc1cc(-c2cc(NC(=O)C(N)Cc3ccccc3)n(C)n2)ccn1.
What is the InChIKey of 2-amino-N-[3-(2-methoxy-4-pyridinyl)-1-methylpyrazol-5-yl]-3-phenylpropanamide?
The InChIKey is MTQPUXOTYVJYHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O2/c1-24-17(12-16(23-24)14-8-9-21-18(11-14)26-2)22-19(25)15(20)10-13-6-4-3-5-7-13/h3-9,11-12,15H,10,20H2,1-2H3,(H,22,25).
What are the key properties of 2-amino-N-[3-(2-methoxy-4-pyridinyl)-1-methylpyrazol-5-yl]-3-phenylpropanamide?
2-amino-N-[3-(2-methoxy-4-pyridinyl)-1-methylpyrazol-5-yl]-3-phenylpropanamide has a molecular weight of 351.41 g/mol, XLogP of 2.00, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[3-(2-methoxy-4-pyridinyl)-1-methylpyrazol-5-yl]-3-phenylpropanamide is sourced from PubChem (CID 67496511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).