N-(4-cyclopentyloxy-3-fluorophenyl)-4-methoxypiperidine-4-carboxamide

C18H25FN2O3 — CID 119806534

IUPACN-(4-cyclopentyloxy-3-fluorophenyl)-4-methoxypiperidine-4-carboxamide
SMILESCOC1(C(=O)Nc2ccc(OC3CCCC3)c(F)c2)CCNCC1
InChIInChI=1S/C18H25FN2O3/c1-23-18(8-10-20-11-9-18)17(22)21-13-6-7-16(15(19)12-13)24-14-4-2-3-5-14/h6-7,12,14,20H,2-5,8-11H2,1H3,(H,21,22)
InChIKeyCMZACIASBFZUDW-UHFFFAOYSA-N
MW336.41 g/mol
LogP2.85
Rot. Bonds5

About N-(4-cyclopentyloxy-3-fluorophenyl)-4-methoxypiperidine-4-carboxamide

N-(4-cyclopentyloxy-3-fluorophenyl)-4-methoxypiperidine-4-carboxamide (PubChem CID 119806534) has the molecular formula C18H25FN2O3 and a molecular weight of 336.41 g/mol. Its IUPAC name is N-(4-cyclopentyloxy-3-fluorophenyl)-4-methoxypiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(4-cyclopentyloxy-3-fluorophenyl)-4-methoxypiperidine-4-carboxamide
PubChem CID119806534
Molecular FormulaC18H25FN2O3
Molecular Weight336.41 g/mol
Exact Mass336.18
IUPAC NameN-(4-cyclopentyloxy-3-fluorophenyl)-4-methoxypiperidine-4-carboxamide
SMILESCOC1(C(=O)Nc2ccc(OC3CCCC3)c(F)c2)CCNCC1
InChIInChI=1S/C18H25FN2O3/c1-23-18(8-10-20-11-9-18)17(22)21-13-6-7-16(15(19)12-13)24-14-4-2-3-5-14/h6-7,12,14,20H,2-5,8-11H2,1H3,(H,21,22)
InChIKeyCMZACIASBFZUDW-UHFFFAOYSA-N
XLogP2.85
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.41
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-fluoro-4-methoxyphenyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119705693
N-(4-cyclopentyloxyphenyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119714806
N-(4-cyclopentyloxy-3-methylphenyl)-1-methoxycycloheptane-1-carboxamide
CID 100705112
N-(4-chloro-3-fluorophenyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119708344
N-[3-fluoro-4-(2-methoxy-4-methylphenoxy)phenyl]-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119751498
N-(4-fluoro-3-methylphenyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119707232
N-(3-bromo-4-fluorophenyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119708380
N-(4-chlorophenyl)-4-methoxypiperidine-4-carboxamide
CID 119671235
N-(4-cyclopentyloxy-3-fluorophenyl)pyrrolidine-2-carboxamide
CID 119336640
N-(3,4-dimethylphenyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119670646
4-methoxy-N-(4-methoxyphenyl)piperidine-4-carboxamide;hydrochloride
CID 119671002
(2S)-2-amino-N-(4-cyclopentyloxy-3-fluorophenyl)propanamide
CID 119336628

Frequently Asked Questions

What is the IUPAC name of N-(4-cyclopentyloxy-3-fluorophenyl)-4-methoxypiperidine-4-carboxamide?
The IUPAC name of N-(4-cyclopentyloxy-3-fluorophenyl)-4-methoxypiperidine-4-carboxamide (CID 119806534) is N-(4-cyclopentyloxy-3-fluorophenyl)-4-methoxypiperidine-4-carboxamide.
What is the SMILES notation for N-(4-cyclopentyloxy-3-fluorophenyl)-4-methoxypiperidine-4-carboxamide?
The canonical SMILES for N-(4-cyclopentyloxy-3-fluorophenyl)-4-methoxypiperidine-4-carboxamide is COC1(C(=O)Nc2ccc(OC3CCCC3)c(F)c2)CCNCC1.
What is the InChIKey of N-(4-cyclopentyloxy-3-fluorophenyl)-4-methoxypiperidine-4-carboxamide?
The InChIKey is CMZACIASBFZUDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25FN2O3/c1-23-18(8-10-20-11-9-18)17(22)21-13-6-7-16(15(19)12-13)24-14-4-2-3-5-14/h6-7,12,14,20H,2-5,8-11H2,1H3,(H,21,22).
What are the key properties of N-(4-cyclopentyloxy-3-fluorophenyl)-4-methoxypiperidine-4-carboxamide?
N-(4-cyclopentyloxy-3-fluorophenyl)-4-methoxypiperidine-4-carboxamide has a molecular weight of 336.41 g/mol, XLogP of 2.85, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyclopentyloxy-3-fluorophenyl)-4-methoxypiperidine-4-carboxamide is sourced from PubChem (CID 119806534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).