N-[4-(4-cyanophenoxy)phenyl]-1-hydroxycyclopentane-1-carboxamide

C19H18N2O3 — CID 110908058

IUPACN-[4-(4-cyanophenoxy)phenyl]-1-hydroxycyclopentane-1-carboxamide
SMILESN#Cc1ccc(Oc2ccc(NC(=O)C3(O)CCCC3)cc2)cc1
InChIInChI=1S/C19H18N2O3/c20-13-14-3-7-16(8-4-14)24-17-9-5-15(6-10-17)21-18(22)19(23)11-1-2-12-19/h3-10,23H,1-2,11-12H2,(H,21,22)
InChIKeyFWPWZNFIOMHIPD-UHFFFAOYSA-N
MW322.36 g/mol
LogP3.59
Rot. Bonds4

About N-[4-(4-cyanophenoxy)phenyl]-1-hydroxycyclopentane-1-carboxamide

N-[4-(4-cyanophenoxy)phenyl]-1-hydroxycyclopentane-1-carboxamide (PubChem CID 110908058) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is N-[4-(4-cyanophenoxy)phenyl]-1-hydroxycyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-[4-(4-cyanophenoxy)phenyl]-1-hydroxycyclopentane-1-carboxamide
PubChem CID110908058
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC NameN-[4-(4-cyanophenoxy)phenyl]-1-hydroxycyclopentane-1-carboxamide
SMILESN#Cc1ccc(Oc2ccc(NC(=O)C3(O)CCCC3)cc2)cc1
InChIInChI=1S/C19H18N2O3/c20-13-14-3-7-16(8-4-14)24-17-9-5-15(6-10-17)21-18(22)19(23)11-1-2-12-19/h3-10,23H,1-2,11-12H2,(H,21,22)
InChIKeyFWPWZNFIOMHIPD-UHFFFAOYSA-N
XLogP3.59
TPSA82.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-(4-cyanophenoxy)phenyl]-1-hydroxycyclopentane-1-carboxamide?
The IUPAC name of N-[4-(4-cyanophenoxy)phenyl]-1-hydroxycyclopentane-1-carboxamide (CID 110908058) is N-[4-(4-cyanophenoxy)phenyl]-1-hydroxycyclopentane-1-carboxamide.
What is the SMILES notation for N-[4-(4-cyanophenoxy)phenyl]-1-hydroxycyclopentane-1-carboxamide?
The canonical SMILES for N-[4-(4-cyanophenoxy)phenyl]-1-hydroxycyclopentane-1-carboxamide is N#Cc1ccc(Oc2ccc(NC(=O)C3(O)CCCC3)cc2)cc1.
What is the InChIKey of N-[4-(4-cyanophenoxy)phenyl]-1-hydroxycyclopentane-1-carboxamide?
The InChIKey is FWPWZNFIOMHIPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c20-13-14-3-7-16(8-4-14)24-17-9-5-15(6-10-17)21-18(22)19(23)11-1-2-12-19/h3-10,23H,1-2,11-12H2,(H,21,22).
What are the key properties of N-[4-(4-cyanophenoxy)phenyl]-1-hydroxycyclopentane-1-carboxamide?
N-[4-(4-cyanophenoxy)phenyl]-1-hydroxycyclopentane-1-carboxamide has a molecular weight of 322.36 g/mol, XLogP of 3.59, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-cyanophenoxy)phenyl]-1-hydroxycyclopentane-1-carboxamide is sourced from PubChem (CID 110908058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).