4-amino-3-methoxy-N-(6-pyrazol-1-yl-3-pyridinyl)butanamide

C13H17N5O2 — CID 103154657

IUPAC4-amino-3-methoxy-N-(6-pyrazol-1-yl-3-pyridinyl)butanamide
SMILESCOC(CN)CC(=O)Nc1ccc(-n2cccn2)nc1
InChIInChI=1S/C13H17N5O2/c1-20-11(8-14)7-13(19)17-10-3-4-12(15-9-10)18-6-2-5-16-18/h2-6,9,11H,7-8,14H2,1H3,(H,17,19)
InChIKeyHUGRQJOHSCSATA-UHFFFAOYSA-N
MW275.31 g/mol
LogP0.57
Rot. Bonds6

About 4-amino-3-methoxy-N-(6-pyrazol-1-yl-3-pyridinyl)butanamide

4-amino-3-methoxy-N-(6-pyrazol-1-yl-3-pyridinyl)butanamide (PubChem CID 103154657) has the molecular formula C13H17N5O2 and a molecular weight of 275.31 g/mol. Its IUPAC name is 4-amino-3-methoxy-N-(6-pyrazol-1-yl-3-pyridinyl)butanamide.

Molecular Properties

Compound Name4-amino-3-methoxy-N-(6-pyrazol-1-yl-3-pyridinyl)butanamide
PubChem CID103154657
Molecular FormulaC13H17N5O2
Molecular Weight275.31 g/mol
Exact Mass275.14
IUPAC Name4-amino-3-methoxy-N-(6-pyrazol-1-yl-3-pyridinyl)butanamide
SMILESCOC(CN)CC(=O)Nc1ccc(-n2cccn2)nc1
InChIInChI=1S/C13H17N5O2/c1-20-11(8-14)7-13(19)17-10-3-4-12(15-9-10)18-6-2-5-16-18/h2-6,9,11H,7-8,14H2,1H3,(H,17,19)
InChIKeyHUGRQJOHSCSATA-UHFFFAOYSA-N
XLogP0.57
TPSA95.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-methyl-N-(6-pyrazol-1-yl-3-pyridinyl)butanamide
CID 25349174
4-amino-3-methoxy-N-(4-pyrazol-1-ylphenyl)butanamide;hydrochloride
CID 120587813
N-(6-pyrazol-1-yl-3-pyridinyl)acetamide
CID 47153389
(2R)-2-methoxy-2-phenyl-N-(6-pyrazol-1-yl-3-pyridinyl)acetamide
CID 95279874
4-amino-3-methoxy-N-(2-pyrazol-1-ylphenyl)butanamide;hydrochloride
CID 120586313
4-phenoxy-N-(6-pyrazol-1-yl-3-pyridinyl)butanamide
CID 25333573
4-amino-N-[6-(4-fluorophenoxy)-3-pyridinyl]-3-methoxybutanamide
CID 120595374
N-(6-pyrazol-1-yl-3-pyridinyl)prop-2-enamide
CID 43698782
4-amino-N-(5-chloro-2-pyrazol-1-ylphenyl)-3-methoxybutanamide
CID 103154914
4-amino-3-methoxy-N-[4-(triazol-2-yl)phenyl]butanamide;hydrochloride
CID 120589330
2-(prop-2-enylamino)-N-(6-pyrazol-1-yl-3-pyridinyl)acetamide
CID 79285864
2,2,2-trifluoroethyl N-(6-pyrazol-1-yl-3-pyridinyl)carbamate
CID 65168775

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-methoxy-N-(6-pyrazol-1-yl-3-pyridinyl)butanamide?
The IUPAC name of 4-amino-3-methoxy-N-(6-pyrazol-1-yl-3-pyridinyl)butanamide (CID 103154657) is 4-amino-3-methoxy-N-(6-pyrazol-1-yl-3-pyridinyl)butanamide.
What is the SMILES notation for 4-amino-3-methoxy-N-(6-pyrazol-1-yl-3-pyridinyl)butanamide?
The canonical SMILES for 4-amino-3-methoxy-N-(6-pyrazol-1-yl-3-pyridinyl)butanamide is COC(CN)CC(=O)Nc1ccc(-n2cccn2)nc1.
What is the InChIKey of 4-amino-3-methoxy-N-(6-pyrazol-1-yl-3-pyridinyl)butanamide?
The InChIKey is HUGRQJOHSCSATA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O2/c1-20-11(8-14)7-13(19)17-10-3-4-12(15-9-10)18-6-2-5-16-18/h2-6,9,11H,7-8,14H2,1H3,(H,17,19).
What are the key properties of 4-amino-3-methoxy-N-(6-pyrazol-1-yl-3-pyridinyl)butanamide?
4-amino-3-methoxy-N-(6-pyrazol-1-yl-3-pyridinyl)butanamide has a molecular weight of 275.31 g/mol, XLogP of 0.57, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-methoxy-N-(6-pyrazol-1-yl-3-pyridinyl)butanamide is sourced from PubChem (CID 103154657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).