4-methoxy-N-[1-(3-propan-2-yloxyphenyl)ethyl]piperidine-4-carboxamide

C18H28N2O3 — CID 119721118

IUPAC4-methoxy-N-[1-(3-propan-2-yloxyphenyl)ethyl]piperidine-4-carboxamide
SMILESCOC1(C(=O)NC(C)c2cccc(OC(C)C)c2)CCNCC1
InChIInChI=1S/C18H28N2O3/c1-13(2)23-16-7-5-6-15(12-16)14(3)20-17(21)18(22-4)8-10-19-11-9-18/h5-7,12-14,19H,8-11H2,1-4H3,(H,20,21)
InChIKeyUUVBBSCIRSVAKB-UHFFFAOYSA-N
MW320.43 g/mol
LogP2.42
Rot. Bonds6

About 4-methoxy-N-[1-(3-propan-2-yloxyphenyl)ethyl]piperidine-4-carboxamide

4-methoxy-N-[1-(3-propan-2-yloxyphenyl)ethyl]piperidine-4-carboxamide (PubChem CID 119721118) has the molecular formula C18H28N2O3 and a molecular weight of 320.43 g/mol. Its IUPAC name is 4-methoxy-N-[1-(3-propan-2-yloxyphenyl)ethyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-[1-(3-propan-2-yloxyphenyl)ethyl]piperidine-4-carboxamide
PubChem CID119721118
Molecular FormulaC18H28N2O3
Molecular Weight320.43 g/mol
Exact Mass320.21
IUPAC Name4-methoxy-N-[1-(3-propan-2-yloxyphenyl)ethyl]piperidine-4-carboxamide
SMILESCOC1(C(=O)NC(C)c2cccc(OC(C)C)c2)CCNCC1
InChIInChI=1S/C18H28N2O3/c1-13(2)23-16-7-5-6-15(12-16)14(3)20-17(21)18(22-4)8-10-19-11-9-18/h5-7,12-14,19H,8-11H2,1-4H3,(H,20,21)
InChIKeyUUVBBSCIRSVAKB-UHFFFAOYSA-N
XLogP2.42
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.43
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(methoxymethyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]piperidine-4-carboxamide
CID 120622091
N-[1-(3-imidazol-1-ylphenyl)ethyl]-4-methoxypiperidine-4-carboxamide
CID 119899677
N-[(1S)-1-(3-methoxyphenyl)ethyl]-3-methylpyrrolidine-3-carboxamide
CID 81373361
4-methoxy-N-[1-(4-methylsulfonylphenyl)ethyl]piperidine-4-carboxamide
CID 119695871
4-methoxy-N-[1-(2-methoxyphenyl)ethyl]piperidine-4-carboxamide;hydrochloride
CID 119683042
4-methoxy-N-[1-(3-methylphenoxy)propan-2-yl]piperidine-4-carboxamide
CID 119742824
N-[2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-4-methoxypiperidine-4-carboxamide
CID 119831064
4-methoxy-N-[1-(3-methoxy-4-phenylmethoxyphenyl)ethyl]piperidine-4-carboxamide;hydrochloride
CID 119721259
N-[1-(2,4-dichlorophenyl)ethyl]-4-methoxypiperidine-4-carboxamide
CID 119683871
N-[(1R)-3-amino-1-(3-chlorophenyl)-3-oxopropyl]-4-methoxypiperidine-4-carboxamide
CID 119820003
4-(methoxymethyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]piperidine-4-carboxamide;hydrochloride
CID 120621541
4-(aminomethyl)-N-[1-(3-propan-2-yloxyphenyl)ethyl]oxane-4-carboxamide;hydrochloride
CID 120923965

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[1-(3-propan-2-yloxyphenyl)ethyl]piperidine-4-carboxamide?
The IUPAC name of 4-methoxy-N-[1-(3-propan-2-yloxyphenyl)ethyl]piperidine-4-carboxamide (CID 119721118) is 4-methoxy-N-[1-(3-propan-2-yloxyphenyl)ethyl]piperidine-4-carboxamide.
What is the SMILES notation for 4-methoxy-N-[1-(3-propan-2-yloxyphenyl)ethyl]piperidine-4-carboxamide?
The canonical SMILES for 4-methoxy-N-[1-(3-propan-2-yloxyphenyl)ethyl]piperidine-4-carboxamide is COC1(C(=O)NC(C)c2cccc(OC(C)C)c2)CCNCC1.
What is the InChIKey of 4-methoxy-N-[1-(3-propan-2-yloxyphenyl)ethyl]piperidine-4-carboxamide?
The InChIKey is UUVBBSCIRSVAKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O3/c1-13(2)23-16-7-5-6-15(12-16)14(3)20-17(21)18(22-4)8-10-19-11-9-18/h5-7,12-14,19H,8-11H2,1-4H3,(H,20,21).
What are the key properties of 4-methoxy-N-[1-(3-propan-2-yloxyphenyl)ethyl]piperidine-4-carboxamide?
4-methoxy-N-[1-(3-propan-2-yloxyphenyl)ethyl]piperidine-4-carboxamide has a molecular weight of 320.43 g/mol, XLogP of 2.42, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[1-(3-propan-2-yloxyphenyl)ethyl]piperidine-4-carboxamide is sourced from PubChem (CID 119721118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).