(2R)-2-acetamido-2-cyclopentyl-N-(6-phenylpyridazin-3-yl)acetamide

C19H22N4O2 — CID 97027786

IUPAC(2R)-2-acetamido-2-cyclopentyl-N-(6-phenylpyridazin-3-yl)acetamide
SMILESCC(=O)N[C@@H](C(=O)Nc1ccc(-c2ccccc2)nn1)C1CCCC1
InChIInChI=1S/C19H22N4O2/c1-13(24)20-18(15-9-5-6-10-15)19(25)21-17-12-11-16(22-23-17)14-7-3-2-4-8-14/h2-4,7-8,11-12,15,18H,5-6,9-10H2,1H3,(H,20,24)(H,21,23,25)/t18-/m1/s1
InChIKeyRKNZBGGKQDGZKV-GOSISDBHSA-N
MW338.41 g/mol
LogP2.78
Rot. Bonds5

About (2R)-2-acetamido-2-cyclopentyl-N-(6-phenylpyridazin-3-yl)acetamide

(2R)-2-acetamido-2-cyclopentyl-N-(6-phenylpyridazin-3-yl)acetamide (PubChem CID 97027786) has the molecular formula C19H22N4O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is (2R)-2-acetamido-2-cyclopentyl-N-(6-phenylpyridazin-3-yl)acetamide.

Molecular Properties

Compound Name(2R)-2-acetamido-2-cyclopentyl-N-(6-phenylpyridazin-3-yl)acetamide
PubChem CID97027786
Molecular FormulaC19H22N4O2
Molecular Weight338.41 g/mol
Exact Mass338.17
IUPAC Name(2R)-2-acetamido-2-cyclopentyl-N-(6-phenylpyridazin-3-yl)acetamide
SMILESCC(=O)N[C@@H](C(=O)Nc1ccc(-c2ccccc2)nn1)C1CCCC1
InChIInChI=1S/C19H22N4O2/c1-13(24)20-18(15-9-5-6-10-15)19(25)21-17-12-11-16(22-23-17)14-7-3-2-4-8-14/h2-4,7-8,11-12,15,18H,5-6,9-10H2,1H3,(H,20,24)(H,21,23,25)/t18-/m1/s1
InChIKeyRKNZBGGKQDGZKV-GOSISDBHSA-N
XLogP2.78
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-acetamido-2-cyclopentyl-N-(6-phenylpyridazin-3-yl)acetamide?
The IUPAC name of (2R)-2-acetamido-2-cyclopentyl-N-(6-phenylpyridazin-3-yl)acetamide (CID 97027786) is (2R)-2-acetamido-2-cyclopentyl-N-(6-phenylpyridazin-3-yl)acetamide.
What is the SMILES notation for (2R)-2-acetamido-2-cyclopentyl-N-(6-phenylpyridazin-3-yl)acetamide?
The canonical SMILES for (2R)-2-acetamido-2-cyclopentyl-N-(6-phenylpyridazin-3-yl)acetamide is CC(=O)N[C@@H](C(=O)Nc1ccc(-c2ccccc2)nn1)C1CCCC1.
What is the InChIKey of (2R)-2-acetamido-2-cyclopentyl-N-(6-phenylpyridazin-3-yl)acetamide?
The InChIKey is RKNZBGGKQDGZKV-GOSISDBHSA-N. The full InChI is InChI=1S/C19H22N4O2/c1-13(24)20-18(15-9-5-6-10-15)19(25)21-17-12-11-16(22-23-17)14-7-3-2-4-8-14/h2-4,7-8,11-12,15,18H,5-6,9-10H2,1H3,(H,20,24)(H,21,23,25)/t18-/m1/s1.
What are the key properties of (2R)-2-acetamido-2-cyclopentyl-N-(6-phenylpyridazin-3-yl)acetamide?
(2R)-2-acetamido-2-cyclopentyl-N-(6-phenylpyridazin-3-yl)acetamide has a molecular weight of 338.41 g/mol, XLogP of 2.78, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-acetamido-2-cyclopentyl-N-(6-phenylpyridazin-3-yl)acetamide is sourced from PubChem (CID 97027786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).