N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxycyclopentane-1-carboxamide

C16H19FN2O2 — CID 110014659

IUPACN-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxycyclopentane-1-carboxamide
SMILESO=C(NCCc1c[nH]c2ccc(F)cc12)C1CCCC1O
InChIInChI=1S/C16H19FN2O2/c17-11-4-5-14-13(8-11)10(9-19-14)6-7-18-16(21)12-2-1-3-15(12)20/h4-5,8-9,12,15,19-20H,1-3,6-7H2,(H,18,21)
InChIKeyPYLCKXZAKUVCNN-UHFFFAOYSA-N
MW290.34 g/mol
LogP2.13
Rot. Bonds4

About N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxycyclopentane-1-carboxamide

N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxycyclopentane-1-carboxamide (PubChem CID 110014659) has the molecular formula C16H19FN2O2 and a molecular weight of 290.34 g/mol. Its IUPAC name is N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxycyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxycyclopentane-1-carboxamide
PubChem CID110014659
Molecular FormulaC16H19FN2O2
Molecular Weight290.34 g/mol
Exact Mass290.14
IUPAC NameN-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxycyclopentane-1-carboxamide
SMILESO=C(NCCc1c[nH]c2ccc(F)cc12)C1CCCC1O
InChIInChI=1S/C16H19FN2O2/c17-11-4-5-14-13(8-11)10(9-19-14)6-7-18-16(21)12-2-1-3-15(12)20/h4-5,8-9,12,15,19-20H,1-3,6-7H2,(H,18,21)
InChIKeyPYLCKXZAKUVCNN-UHFFFAOYSA-N
XLogP2.13
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.34
LogP ≤ 52.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxycyclopentane-1-carboxamide?
The IUPAC name of N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxycyclopentane-1-carboxamide (CID 110014659) is N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxycyclopentane-1-carboxamide.
What is the SMILES notation for N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxycyclopentane-1-carboxamide?
The canonical SMILES for N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxycyclopentane-1-carboxamide is O=C(NCCc1c[nH]c2ccc(F)cc12)C1CCCC1O.
What is the InChIKey of N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxycyclopentane-1-carboxamide?
The InChIKey is PYLCKXZAKUVCNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN2O2/c17-11-4-5-14-13(8-11)10(9-19-14)6-7-18-16(21)12-2-1-3-15(12)20/h4-5,8-9,12,15,19-20H,1-3,6-7H2,(H,18,21).
What are the key properties of N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxycyclopentane-1-carboxamide?
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxycyclopentane-1-carboxamide has a molecular weight of 290.34 g/mol, XLogP of 2.13, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-hydroxycyclopentane-1-carboxamide is sourced from PubChem (CID 110014659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).