N-(1-cyclopentyl-4-methylpyrazol-5-yl)-2-[(4-fluorophenyl)methyl-methylamino]acetamide

C19H25FN4O — CID 134696922

IUPACN-(1-cyclopentyl-4-methylpyrazol-5-yl)-2-[(4-fluorophenyl)methyl-methylamino]acetamide
SMILESCc1cnn(C2CCCC2)c1NC(=O)CN(C)Cc1ccc(F)cc1
InChIInChI=1S/C19H25FN4O/c1-14-11-21-24(17-5-3-4-6-17)19(14)22-18(25)13-23(2)12-15-7-9-16(20)10-8-15/h7-11,17H,3-6,12-13H2,1-2H3,(H,22,25)
InChIKeyDVHQVQCCXPDCPF-UHFFFAOYSA-N
MW344.43 g/mol
LogP3.52
Rot. Bonds6

About N-(1-cyclopentyl-4-methylpyrazol-5-yl)-2-[(4-fluorophenyl)methyl-methylamino]acetamide

N-(1-cyclopentyl-4-methylpyrazol-5-yl)-2-[(4-fluorophenyl)methyl-methylamino]acetamide (PubChem CID 134696922) has the molecular formula C19H25FN4O and a molecular weight of 344.43 g/mol. Its IUPAC name is N-(1-cyclopentyl-4-methylpyrazol-5-yl)-2-[(4-fluorophenyl)methyl-methylamino]acetamide.

Molecular Properties

Compound NameN-(1-cyclopentyl-4-methylpyrazol-5-yl)-2-[(4-fluorophenyl)methyl-methylamino]acetamide
PubChem CID134696922
Molecular FormulaC19H25FN4O
Molecular Weight344.43 g/mol
Exact Mass344.20
IUPAC NameN-(1-cyclopentyl-4-methylpyrazol-5-yl)-2-[(4-fluorophenyl)methyl-methylamino]acetamide
SMILESCc1cnn(C2CCCC2)c1NC(=O)CN(C)Cc1ccc(F)cc1
InChIInChI=1S/C19H25FN4O/c1-14-11-21-24(17-5-3-4-6-17)19(14)22-18(25)13-23(2)12-15-7-9-16(20)10-8-15/h7-11,17H,3-6,12-13H2,1-2H3,(H,22,25)
InChIKeyDVHQVQCCXPDCPF-UHFFFAOYSA-N
XLogP3.52
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.43
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopentyl-4-methylpyrazol-5-yl)-2-[(4-fluorophenyl)methyl-methylamino]acetamide?
The IUPAC name of N-(1-cyclopentyl-4-methylpyrazol-5-yl)-2-[(4-fluorophenyl)methyl-methylamino]acetamide (CID 134696922) is N-(1-cyclopentyl-4-methylpyrazol-5-yl)-2-[(4-fluorophenyl)methyl-methylamino]acetamide.
What is the SMILES notation for N-(1-cyclopentyl-4-methylpyrazol-5-yl)-2-[(4-fluorophenyl)methyl-methylamino]acetamide?
The canonical SMILES for N-(1-cyclopentyl-4-methylpyrazol-5-yl)-2-[(4-fluorophenyl)methyl-methylamino]acetamide is Cc1cnn(C2CCCC2)c1NC(=O)CN(C)Cc1ccc(F)cc1.
What is the InChIKey of N-(1-cyclopentyl-4-methylpyrazol-5-yl)-2-[(4-fluorophenyl)methyl-methylamino]acetamide?
The InChIKey is DVHQVQCCXPDCPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25FN4O/c1-14-11-21-24(17-5-3-4-6-17)19(14)22-18(25)13-23(2)12-15-7-9-16(20)10-8-15/h7-11,17H,3-6,12-13H2,1-2H3,(H,22,25).
What are the key properties of N-(1-cyclopentyl-4-methylpyrazol-5-yl)-2-[(4-fluorophenyl)methyl-methylamino]acetamide?
N-(1-cyclopentyl-4-methylpyrazol-5-yl)-2-[(4-fluorophenyl)methyl-methylamino]acetamide has a molecular weight of 344.43 g/mol, XLogP of 3.52, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopentyl-4-methylpyrazol-5-yl)-2-[(4-fluorophenyl)methyl-methylamino]acetamide is sourced from PubChem (CID 134696922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).