N-(2-ethoxyphenyl)-2-[4-(1-methylpyrazol-4-yl)-3,6-dihydro-2H-pyridin-1-yl]acetamide

C19H24N4O2 — CID 53026941

IUPACN-(2-ethoxyphenyl)-2-[4-(1-methylpyrazol-4-yl)-3,6-dihydro-2H-pyridin-1-yl]acetamide
SMILESCCOc1ccccc1NC(=O)CN1CC=C(c2cnn(C)c2)CC1
InChIInChI=1S/C19H24N4O2/c1-3-25-18-7-5-4-6-17(18)21-19(24)14-23-10-8-15(9-11-23)16-12-20-22(2)13-16/h4-8,12-13H,3,9-11,14H2,1-2H3,(H,21,24)
InChIKeyIPEHPJWEOLZNSF-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.55
Rot. Bonds6

About N-(2-ethoxyphenyl)-2-[4-(1-methylpyrazol-4-yl)-3,6-dihydro-2H-pyridin-1-yl]acetamide

N-(2-ethoxyphenyl)-2-[4-(1-methylpyrazol-4-yl)-3,6-dihydro-2H-pyridin-1-yl]acetamide (PubChem CID 53026941) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-2-[4-(1-methylpyrazol-4-yl)-3,6-dihydro-2H-pyridin-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-2-[4-(1-methylpyrazol-4-yl)-3,6-dihydro-2H-pyridin-1-yl]acetamide
PubChem CID53026941
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN-(2-ethoxyphenyl)-2-[4-(1-methylpyrazol-4-yl)-3,6-dihydro-2H-pyridin-1-yl]acetamide
SMILESCCOc1ccccc1NC(=O)CN1CC=C(c2cnn(C)c2)CC1
InChIInChI=1S/C19H24N4O2/c1-3-25-18-7-5-4-6-17(18)21-19(24)14-23-10-8-15(9-11-23)16-12-20-22(2)13-16/h4-8,12-13H,3,9-11,14H2,1-2H3,(H,21,24)
InChIKeyIPEHPJWEOLZNSF-UHFFFAOYSA-N
XLogP2.55
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-2-[4-(1-methylpyrazol-4-yl)-3,6-dihydro-2H-pyridin-1-yl]acetamide?
The IUPAC name of N-(2-ethoxyphenyl)-2-[4-(1-methylpyrazol-4-yl)-3,6-dihydro-2H-pyridin-1-yl]acetamide (CID 53026941) is N-(2-ethoxyphenyl)-2-[4-(1-methylpyrazol-4-yl)-3,6-dihydro-2H-pyridin-1-yl]acetamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-2-[4-(1-methylpyrazol-4-yl)-3,6-dihydro-2H-pyridin-1-yl]acetamide?
The canonical SMILES for N-(2-ethoxyphenyl)-2-[4-(1-methylpyrazol-4-yl)-3,6-dihydro-2H-pyridin-1-yl]acetamide is CCOc1ccccc1NC(=O)CN1CC=C(c2cnn(C)c2)CC1.
What is the InChIKey of N-(2-ethoxyphenyl)-2-[4-(1-methylpyrazol-4-yl)-3,6-dihydro-2H-pyridin-1-yl]acetamide?
The InChIKey is IPEHPJWEOLZNSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-3-25-18-7-5-4-6-17(18)21-19(24)14-23-10-8-15(9-11-23)16-12-20-22(2)13-16/h4-8,12-13H,3,9-11,14H2,1-2H3,(H,21,24).
What are the key properties of N-(2-ethoxyphenyl)-2-[4-(1-methylpyrazol-4-yl)-3,6-dihydro-2H-pyridin-1-yl]acetamide?
N-(2-ethoxyphenyl)-2-[4-(1-methylpyrazol-4-yl)-3,6-dihydro-2H-pyridin-1-yl]acetamide has a molecular weight of 340.43 g/mol, XLogP of 2.55, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-2-[4-(1-methylpyrazol-4-yl)-3,6-dihydro-2H-pyridin-1-yl]acetamide is sourced from PubChem (CID 53026941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).