4-methoxy-N-[3-(2-methoxypropanoylamino)phenyl]piperidine-4-carboxamide

C17H25N3O4 — CID 119751959

IUPAC4-methoxy-N-[3-(2-methoxypropanoylamino)phenyl]piperidine-4-carboxamide
SMILESCOC(C)C(=O)Nc1cccc(NC(=O)C2(OC)CCNCC2)c1
InChIInChI=1S/C17H25N3O4/c1-12(23-2)15(21)19-13-5-4-6-14(11-13)20-16(22)17(24-3)7-9-18-10-8-17/h4-6,11-12,18H,7-10H2,1-3H3,(H,19,21)(H,20,22)
InChIKeySXSIVMFPXNQSMU-UHFFFAOYSA-N
MW335.40 g/mol
LogP1.37
Rot. Bonds6

About 4-methoxy-N-[3-(2-methoxypropanoylamino)phenyl]piperidine-4-carboxamide

4-methoxy-N-[3-(2-methoxypropanoylamino)phenyl]piperidine-4-carboxamide (PubChem CID 119751959) has the molecular formula C17H25N3O4 and a molecular weight of 335.40 g/mol. Its IUPAC name is 4-methoxy-N-[3-(2-methoxypropanoylamino)phenyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-[3-(2-methoxypropanoylamino)phenyl]piperidine-4-carboxamide
PubChem CID119751959
Molecular FormulaC17H25N3O4
Molecular Weight335.40 g/mol
Exact Mass335.18
IUPAC Name4-methoxy-N-[3-(2-methoxypropanoylamino)phenyl]piperidine-4-carboxamide
SMILESCOC(C)C(=O)Nc1cccc(NC(=O)C2(OC)CCNCC2)c1
InChIInChI=1S/C17H25N3O4/c1-12(23-2)15(21)19-13-5-4-6-14(11-13)20-16(22)17(24-3)7-9-18-10-8-17/h4-6,11-12,18H,7-10H2,1-3H3,(H,19,21)(H,20,22)
InChIKeySXSIVMFPXNQSMU-UHFFFAOYSA-N
XLogP1.37
TPSA88.69 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.40
LogP ≤ 51.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(cyclopropanecarbonylamino)phenyl]-4-methoxypiperidine-4-carboxamide
CID 119710488
N-[3-(difluoromethylsulfanyl)phenyl]-4-methoxypiperidine-4-carboxamide
CID 119770540
N-(3-ethylphenyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119675705
N-(3-ethylsulfanylphenyl)-4-methoxypiperidine-4-carboxamide
CID 119787035
N-[3-(2-methoxypropanoylamino)phenyl]piperidine-4-carboxamide;hydrochloride
CID 119305159
4-methoxy-N-[4-(phenylcarbamoylamino)phenyl]piperidine-4-carboxamide;hydrochloride
CID 119700736
4-methoxy-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide;hydrochloride
CID 119672814
N-[3-(4-chlorophenyl)sulfanylphenyl]-4-methoxypiperidine-4-carboxamide
CID 119813165
4-methoxy-N-[3-(3,3,3-trifluoropropyl)phenyl]piperidine-4-carboxamide;hydrochloride
CID 119819398
N-[3-[2-(dimethylamino)ethoxy]phenyl]-4-methoxypiperidine-4-carboxamide
CID 119844483
4-methoxy-N-[4-(phenylcarbamoyl)phenyl]piperidine-4-carboxamide
CID 119756449
N-(3-bromo-4-methylphenyl)-4-methoxypiperidine-4-carboxamide
CID 119704635

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[3-(2-methoxypropanoylamino)phenyl]piperidine-4-carboxamide?
The IUPAC name of 4-methoxy-N-[3-(2-methoxypropanoylamino)phenyl]piperidine-4-carboxamide (CID 119751959) is 4-methoxy-N-[3-(2-methoxypropanoylamino)phenyl]piperidine-4-carboxamide.
What is the SMILES notation for 4-methoxy-N-[3-(2-methoxypropanoylamino)phenyl]piperidine-4-carboxamide?
The canonical SMILES for 4-methoxy-N-[3-(2-methoxypropanoylamino)phenyl]piperidine-4-carboxamide is COC(C)C(=O)Nc1cccc(NC(=O)C2(OC)CCNCC2)c1.
What is the InChIKey of 4-methoxy-N-[3-(2-methoxypropanoylamino)phenyl]piperidine-4-carboxamide?
The InChIKey is SXSIVMFPXNQSMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O4/c1-12(23-2)15(21)19-13-5-4-6-14(11-13)20-16(22)17(24-3)7-9-18-10-8-17/h4-6,11-12,18H,7-10H2,1-3H3,(H,19,21)(H,20,22).
What are the key properties of 4-methoxy-N-[3-(2-methoxypropanoylamino)phenyl]piperidine-4-carboxamide?
4-methoxy-N-[3-(2-methoxypropanoylamino)phenyl]piperidine-4-carboxamide has a molecular weight of 335.40 g/mol, XLogP of 1.37, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[3-(2-methoxypropanoylamino)phenyl]piperidine-4-carboxamide is sourced from PubChem (CID 119751959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).