N-[(1R)-1-cyclobutylethyl]-4-[(2-methoxyphenyl)methoxy]piperidine-1-carboxamide

C20H30N2O3 — CID 97160902

IUPACN-[(1R)-1-cyclobutylethyl]-4-[(2-methoxyphenyl)methoxy]piperidine-1-carboxamide
SMILESCOc1ccccc1COC1CCN(C(=O)N[C@H](C)C2CCC2)CC1
InChIInChI=1S/C20H30N2O3/c1-15(16-7-5-8-16)21-20(23)22-12-10-18(11-13-22)25-14-17-6-3-4-9-19(17)24-2/h3-4,6,9,15-16,18H,5,7-8,10-14H2,1-2H3,(H,21,23)/t15-/m1/s1
InChIKeyPNTFVCFDVASVBM-OAHLLOKOSA-N
MW346.47 g/mol
LogP3.57
Rot. Bonds6

About N-[(1R)-1-cyclobutylethyl]-4-[(2-methoxyphenyl)methoxy]piperidine-1-carboxamide

N-[(1R)-1-cyclobutylethyl]-4-[(2-methoxyphenyl)methoxy]piperidine-1-carboxamide (PubChem CID 97160902) has the molecular formula C20H30N2O3 and a molecular weight of 346.47 g/mol. Its IUPAC name is N-[(1R)-1-cyclobutylethyl]-4-[(2-methoxyphenyl)methoxy]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-cyclobutylethyl]-4-[(2-methoxyphenyl)methoxy]piperidine-1-carboxamide
PubChem CID97160902
Molecular FormulaC20H30N2O3
Molecular Weight346.47 g/mol
Exact Mass346.23
IUPAC NameN-[(1R)-1-cyclobutylethyl]-4-[(2-methoxyphenyl)methoxy]piperidine-1-carboxamide
SMILESCOc1ccccc1COC1CCN(C(=O)N[C@H](C)C2CCC2)CC1
InChIInChI=1S/C20H30N2O3/c1-15(16-7-5-8-16)21-20(23)22-12-10-18(11-13-22)25-14-17-6-3-4-9-19(17)24-2/h3-4,6,9,15-16,18H,5,7-8,10-14H2,1-2H3,(H,21,23)/t15-/m1/s1
InChIKeyPNTFVCFDVASVBM-OAHLLOKOSA-N
XLogP3.57
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.47
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-cyclobutylethyl)-4-[(2-methoxyphenyl)methoxy]piperidine-1-carboxamide
CID 84593996
3-amino-1-[4-[(2-methoxyphenyl)methoxy]piperidin-1-yl]butan-1-one
CID 120873928
[4-[(2-methoxyphenyl)methoxy]piperidin-1-yl]-[(2R,3S)-2-methyloxan-3-yl]methanone
CID 129400330
[4-[(2-methoxyphenyl)methoxy]piperidin-1-yl]-[(2S,3S)-2-methyloxan-3-yl]methanone
CID 129400331
(4-fluorophenyl)-[4-[(2-methoxyphenyl)methoxy]piperidin-1-yl]methanone
CID 84594202
4-[4-[(2-methoxyphenyl)methoxy]piperidine-1-carbonyl]cyclohexane-1-carboxylic acid
CID 120674625
3-[4-[(2-methoxyphenyl)methoxy]piperidine-1-carbonyl]benzoic acid
CID 120551630
1-N-[1-(2-methoxyphenyl)propan-2-yl]piperidine-1,4-dicarboxamide
CID 56798078
4-[[2-(2-methoxyphenoxy)acetyl]amino]-N-propan-2-ylpiperidine-1-carboxamide
CID 110822362
(3S)-1-N-[(2R)-1-(2-methoxyphenyl)propan-2-yl]pyrrolidine-1,3-dicarboxamide
CID 95579656
1-[4-(3-aminopropoxy)piperidin-1-yl]-4-(2-methoxyphenyl)-3-methylbutan-1-one
CID 119661795
1-[[1-(2-methoxyphenyl)-3-methylbutan-2-yl]carbamoyl]pyrrolidine-3-carboxylic acid
CID 122004989

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-cyclobutylethyl]-4-[(2-methoxyphenyl)methoxy]piperidine-1-carboxamide?
The IUPAC name of N-[(1R)-1-cyclobutylethyl]-4-[(2-methoxyphenyl)methoxy]piperidine-1-carboxamide (CID 97160902) is N-[(1R)-1-cyclobutylethyl]-4-[(2-methoxyphenyl)methoxy]piperidine-1-carboxamide.
What is the SMILES notation for N-[(1R)-1-cyclobutylethyl]-4-[(2-methoxyphenyl)methoxy]piperidine-1-carboxamide?
The canonical SMILES for N-[(1R)-1-cyclobutylethyl]-4-[(2-methoxyphenyl)methoxy]piperidine-1-carboxamide is COc1ccccc1COC1CCN(C(=O)N[C@H](C)C2CCC2)CC1.
What is the InChIKey of N-[(1R)-1-cyclobutylethyl]-4-[(2-methoxyphenyl)methoxy]piperidine-1-carboxamide?
The InChIKey is PNTFVCFDVASVBM-OAHLLOKOSA-N. The full InChI is InChI=1S/C20H30N2O3/c1-15(16-7-5-8-16)21-20(23)22-12-10-18(11-13-22)25-14-17-6-3-4-9-19(17)24-2/h3-4,6,9,15-16,18H,5,7-8,10-14H2,1-2H3,(H,21,23)/t15-/m1/s1.
What are the key properties of N-[(1R)-1-cyclobutylethyl]-4-[(2-methoxyphenyl)methoxy]piperidine-1-carboxamide?
N-[(1R)-1-cyclobutylethyl]-4-[(2-methoxyphenyl)methoxy]piperidine-1-carboxamide has a molecular weight of 346.47 g/mol, XLogP of 3.57, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-cyclobutylethyl]-4-[(2-methoxyphenyl)methoxy]piperidine-1-carboxamide is sourced from PubChem (CID 97160902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).