N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]piperidine-3-carboxamide

C20H30N2O3 — CID 119288176

IUPACN-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]piperidine-3-carboxamide
SMILESCOc1cc(C(C)NC(=O)C2CCCNC2)ccc1OC1CCCC1
InChIInChI=1S/C20H30N2O3/c1-14(22-20(23)16-6-5-11-21-13-16)15-9-10-18(19(12-15)24-2)25-17-7-3-4-8-17/h9-10,12,14,16-17,21H,3-8,11,13H2,1-2H3,(H,22,23)
InChIKeyUTKZIJRTJAGJLD-UHFFFAOYSA-N
MW346.47 g/mol
LogP3.19
Rot. Bonds6

About N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]piperidine-3-carboxamide

N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]piperidine-3-carboxamide (PubChem CID 119288176) has the molecular formula C20H30N2O3 and a molecular weight of 346.47 g/mol. Its IUPAC name is N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]piperidine-3-carboxamide
PubChem CID119288176
Molecular FormulaC20H30N2O3
Molecular Weight346.47 g/mol
Exact Mass346.23
IUPAC NameN-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]piperidine-3-carboxamide
SMILESCOc1cc(C(C)NC(=O)C2CCCNC2)ccc1OC1CCCC1
InChIInChI=1S/C20H30N2O3/c1-14(22-20(23)16-6-5-11-21-13-16)15-9-10-18(19(12-15)24-2)25-17-7-3-4-8-17/h9-10,12,14,16-17,21H,3-8,11,13H2,1-2H3,(H,22,23)
InChIKeyUTKZIJRTJAGJLD-UHFFFAOYSA-N
XLogP3.19
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.47
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]pyrrolidine-3-carboxamide
CID 119721176
N-[1-(3-fluoro-4-methoxyphenyl)ethyl]piperidine-3-carboxamide
CID 43709600
(3S)-N-[1-(3-fluoro-4-methoxyphenyl)ethyl]piperidine-3-carboxamide
CID 81124863
N-[1-(3,4,5-trimethoxyphenyl)ethyl]piperidine-3-carboxamide
CID 119287644
N-[1-(3-methoxy-4-phenylmethoxyphenyl)ethyl]piperidine-3-carboxamide
CID 119288240
N-[1-(3,4-dimethoxyphenyl)ethyl]piperidine-4-carboxamide
CID 61166375
N-[1-(3,4-dimethoxyphenyl)ethyl]piperidine-4-carboxamide;hydrochloride
CID 119287478
N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]morpholine-3-carboxamide
CID 119721132
N-[1-(2,5-dimethoxyphenyl)ethyl]piperidine-3-carboxamide;hydrochloride
CID 119272446
N-[1-(4-propan-2-ylphenyl)ethyl]piperidine-3-carboxamide;hydrochloride
CID 119269407
(3S)-N-[1-(2-methoxyphenyl)ethyl]piperidine-3-carboxamide
CID 81141408
(3R)-N-[(1S)-1-(4-methylphenyl)ethyl]piperidine-3-carboxamide
CID 81355974

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]piperidine-3-carboxamide?
The IUPAC name of N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]piperidine-3-carboxamide (CID 119288176) is N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]piperidine-3-carboxamide.
What is the SMILES notation for N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]piperidine-3-carboxamide?
The canonical SMILES for N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]piperidine-3-carboxamide is COc1cc(C(C)NC(=O)C2CCCNC2)ccc1OC1CCCC1.
What is the InChIKey of N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]piperidine-3-carboxamide?
The InChIKey is UTKZIJRTJAGJLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O3/c1-14(22-20(23)16-6-5-11-21-13-16)15-9-10-18(19(12-15)24-2)25-17-7-3-4-8-17/h9-10,12,14,16-17,21H,3-8,11,13H2,1-2H3,(H,22,23).
What are the key properties of N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]piperidine-3-carboxamide?
N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]piperidine-3-carboxamide has a molecular weight of 346.47 g/mol, XLogP of 3.19, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]piperidine-3-carboxamide is sourced from PubChem (CID 119288176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).