N-cyclopentyl-N-phenyl-2-[4-(tetrazol-1-yl)phenyl]acetamide

C20H21N5O — CID 75462753

IUPACN-cyclopentyl-N-phenyl-2-[4-(tetrazol-1-yl)phenyl]acetamide
SMILESO=C(Cc1ccc(-n2cnnn2)cc1)N(c1ccccc1)C1CCCC1
InChIInChI=1S/C20H21N5O/c26-20(14-16-10-12-17(13-11-16)24-15-21-22-23-24)25(19-8-4-5-9-19)18-6-2-1-3-7-18/h1-3,6-7,10-13,15,19H,4-5,8-9,14H2
InChIKeyJDKYWFVBWNHIDN-UHFFFAOYSA-N
MW347.42 g/mol
LogP3.18
Rot. Bonds5

About N-cyclopentyl-N-phenyl-2-[4-(tetrazol-1-yl)phenyl]acetamide

N-cyclopentyl-N-phenyl-2-[4-(tetrazol-1-yl)phenyl]acetamide (PubChem CID 75462753) has the molecular formula C20H21N5O and a molecular weight of 347.42 g/mol. Its IUPAC name is N-cyclopentyl-N-phenyl-2-[4-(tetrazol-1-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-N-phenyl-2-[4-(tetrazol-1-yl)phenyl]acetamide
PubChem CID75462753
Molecular FormulaC20H21N5O
Molecular Weight347.42 g/mol
Exact Mass347.17
IUPAC NameN-cyclopentyl-N-phenyl-2-[4-(tetrazol-1-yl)phenyl]acetamide
SMILESO=C(Cc1ccc(-n2cnnn2)cc1)N(c1ccccc1)C1CCCC1
InChIInChI=1S/C20H21N5O/c26-20(14-16-10-12-17(13-11-16)24-15-21-22-23-24)25(19-8-4-5-9-19)18-6-2-1-3-7-18/h1-3,6-7,10-13,15,19H,4-5,8-9,14H2
InChIKeyJDKYWFVBWNHIDN-UHFFFAOYSA-N
XLogP3.18
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-phenyl-2-[4-(tetrazol-1-yl)phenyl]acetamide?
The IUPAC name of N-cyclopentyl-N-phenyl-2-[4-(tetrazol-1-yl)phenyl]acetamide (CID 75462753) is N-cyclopentyl-N-phenyl-2-[4-(tetrazol-1-yl)phenyl]acetamide.
What is the SMILES notation for N-cyclopentyl-N-phenyl-2-[4-(tetrazol-1-yl)phenyl]acetamide?
The canonical SMILES for N-cyclopentyl-N-phenyl-2-[4-(tetrazol-1-yl)phenyl]acetamide is O=C(Cc1ccc(-n2cnnn2)cc1)N(c1ccccc1)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-phenyl-2-[4-(tetrazol-1-yl)phenyl]acetamide?
The InChIKey is JDKYWFVBWNHIDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N5O/c26-20(14-16-10-12-17(13-11-16)24-15-21-22-23-24)25(19-8-4-5-9-19)18-6-2-1-3-7-18/h1-3,6-7,10-13,15,19H,4-5,8-9,14H2.
What are the key properties of N-cyclopentyl-N-phenyl-2-[4-(tetrazol-1-yl)phenyl]acetamide?
N-cyclopentyl-N-phenyl-2-[4-(tetrazol-1-yl)phenyl]acetamide has a molecular weight of 347.42 g/mol, XLogP of 3.18, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-phenyl-2-[4-(tetrazol-1-yl)phenyl]acetamide is sourced from PubChem (CID 75462753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).