N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-4-(methoxymethyl)piperidine-4-carboxamide

C20H30FN3O2 — CID 120641513

IUPACN-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-4-(methoxymethyl)piperidine-4-carboxamide
SMILESCOCC1(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CCNCC1
InChIInChI=1S/C20H30FN3O2/c1-26-15-20(8-10-22-11-9-20)19(25)23-18-6-12-24(13-7-18)14-16-2-4-17(21)5-3-16/h2-5,18,22H,6-15H2,1H3,(H,23,25)
InChIKeyVAUHGAKBKRFZFU-UHFFFAOYSA-N
MW363.48 g/mol
LogP1.92
Rot. Bonds6

About N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-4-(methoxymethyl)piperidine-4-carboxamide

N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-4-(methoxymethyl)piperidine-4-carboxamide (PubChem CID 120641513) has the molecular formula C20H30FN3O2 and a molecular weight of 363.48 g/mol. Its IUPAC name is N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-4-(methoxymethyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-4-(methoxymethyl)piperidine-4-carboxamide
PubChem CID120641513
Molecular FormulaC20H30FN3O2
Molecular Weight363.48 g/mol
Exact Mass363.23
IUPAC NameN-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-4-(methoxymethyl)piperidine-4-carboxamide
SMILESCOCC1(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CCNCC1
InChIInChI=1S/C20H30FN3O2/c1-26-15-20(8-10-22-11-9-20)19(25)23-18-6-12-24(13-7-18)14-16-2-4-17(21)5-3-16/h2-5,18,22H,6-15H2,1H3,(H,23,25)
InChIKeyVAUHGAKBKRFZFU-UHFFFAOYSA-N
XLogP1.92
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.48
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-4-(methoxymethyl)piperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(methoxymethyl)-N-[1-[(2-methylphenyl)methyl]piperidin-4-yl]piperidine-4-carboxamide
CID 120641523
4-(methoxymethyl)-N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]piperidine-4-carboxamide
CID 120647651
4-(methoxymethyl)-N-[[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methyl]piperidine-4-carboxamide
CID 120645450
1-amino-N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]cyclopentane-1-carboxamide;dihydrochloride
CID 119844644
2-(3,4-dimethoxyphenyl)-N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]acetamide
CID 55959801
N-cyclohex-3-en-1-yl-4-(methoxymethyl)piperidine-4-carboxamide
CID 114042043
2,2-difluoro-N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]propanamide
CID 158389196
1-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-3-(4-methylcyclohexyl)urea
CID 87034548
N-[3-[[4-(hydroxymethyl)piperidin-1-yl]methyl]phenyl]-4-(methoxymethyl)piperidine-4-carboxamide
CID 120645907
2,2,2-trifluoro-N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]acetamide
CID 126711751
2-(4-tert-butylphenoxy)-N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]acetamide
CID 86812678
[4-[(4-ethoxyphenyl)methyl]piperazin-1-yl]-[4-(methoxymethyl)piperidin-4-yl]methanone
CID 120640711

Frequently Asked Questions

What is the IUPAC name of N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-4-(methoxymethyl)piperidine-4-carboxamide?
The IUPAC name of N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-4-(methoxymethyl)piperidine-4-carboxamide (CID 120641513) is N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-4-(methoxymethyl)piperidine-4-carboxamide.
What is the SMILES notation for N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-4-(methoxymethyl)piperidine-4-carboxamide?
The canonical SMILES for N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-4-(methoxymethyl)piperidine-4-carboxamide is COCC1(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CCNCC1.
What is the InChIKey of N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-4-(methoxymethyl)piperidine-4-carboxamide?
The InChIKey is VAUHGAKBKRFZFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30FN3O2/c1-26-15-20(8-10-22-11-9-20)19(25)23-18-6-12-24(13-7-18)14-16-2-4-17(21)5-3-16/h2-5,18,22H,6-15H2,1H3,(H,23,25).
What are the key properties of N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-4-(methoxymethyl)piperidine-4-carboxamide?
N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-4-(methoxymethyl)piperidine-4-carboxamide has a molecular weight of 363.48 g/mol, XLogP of 1.92, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-4-(methoxymethyl)piperidine-4-carboxamide is sourced from PubChem (CID 120641513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).