N-cyclohexyl-N-methyl-2-(8-methyl-4H-chromeno[3,4-d]pyrazol-1-yl)acetamide

C20H25N3O2 — CID 6620132

IUPACN-cyclohexyl-N-methyl-2-(8-methyl-4H-chromeno[3,4-d]pyrazol-1-yl)acetamide
SMILESCc1ccc2c(c1)-c1c(cnn1CC(=O)N(C)C1CCCCC1)CO2
InChIInChI=1S/C20H25N3O2/c1-14-8-9-18-17(10-14)20-15(13-25-18)11-21-23(20)12-19(24)22(2)16-6-4-3-5-7-16/h8-11,16H,3-7,12-13H2,1-2H3
InChIKeyMKUDSFFAMKBKJY-UHFFFAOYSA-N
MW339.44 g/mol
LogP3.54
Rot. Bonds3

About N-cyclohexyl-N-methyl-2-(8-methyl-4H-chromeno[3,4-d]pyrazol-1-yl)acetamide

N-cyclohexyl-N-methyl-2-(8-methyl-4H-chromeno[3,4-d]pyrazol-1-yl)acetamide (PubChem CID 6620132) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-2-(8-methyl-4H-chromeno[3,4-d]pyrazol-1-yl)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-2-(8-methyl-4H-chromeno[3,4-d]pyrazol-1-yl)acetamide
PubChem CID6620132
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC NameN-cyclohexyl-N-methyl-2-(8-methyl-4H-chromeno[3,4-d]pyrazol-1-yl)acetamide
SMILESCc1ccc2c(c1)-c1c(cnn1CC(=O)N(C)C1CCCCC1)CO2
InChIInChI=1S/C20H25N3O2/c1-14-8-9-18-17(10-14)20-15(13-25-18)11-21-23(20)12-19(24)22(2)16-6-4-3-5-7-16/h8-11,16H,3-7,12-13H2,1-2H3
InChIKeyMKUDSFFAMKBKJY-UHFFFAOYSA-N
XLogP3.54
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyl-2-(8-methyl-4H-chromeno[3,4-d]pyrazol-1-yl)acetamide?
The IUPAC name of N-cyclohexyl-N-methyl-2-(8-methyl-4H-chromeno[3,4-d]pyrazol-1-yl)acetamide (CID 6620132) is N-cyclohexyl-N-methyl-2-(8-methyl-4H-chromeno[3,4-d]pyrazol-1-yl)acetamide.
What is the SMILES notation for N-cyclohexyl-N-methyl-2-(8-methyl-4H-chromeno[3,4-d]pyrazol-1-yl)acetamide?
The canonical SMILES for N-cyclohexyl-N-methyl-2-(8-methyl-4H-chromeno[3,4-d]pyrazol-1-yl)acetamide is Cc1ccc2c(c1)-c1c(cnn1CC(=O)N(C)C1CCCCC1)CO2.
What is the InChIKey of N-cyclohexyl-N-methyl-2-(8-methyl-4H-chromeno[3,4-d]pyrazol-1-yl)acetamide?
The InChIKey is MKUDSFFAMKBKJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-14-8-9-18-17(10-14)20-15(13-25-18)11-21-23(20)12-19(24)22(2)16-6-4-3-5-7-16/h8-11,16H,3-7,12-13H2,1-2H3.
What are the key properties of N-cyclohexyl-N-methyl-2-(8-methyl-4H-chromeno[3,4-d]pyrazol-1-yl)acetamide?
N-cyclohexyl-N-methyl-2-(8-methyl-4H-chromeno[3,4-d]pyrazol-1-yl)acetamide has a molecular weight of 339.44 g/mol, XLogP of 3.54, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-2-(8-methyl-4H-chromeno[3,4-d]pyrazol-1-yl)acetamide is sourced from PubChem (CID 6620132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).