4-[1-(2-methoxyacetyl)pyrrolidin-3-yl]-N-methylpiperidine-1-carboxamide

C14H25N3O3 — CID 91916509

IUPAC4-[1-(2-methoxyacetyl)pyrrolidin-3-yl]-N-methylpiperidine-1-carboxamide
SMILESCNC(=O)N1CCC(C2CCN(C(=O)COC)C2)CC1
InChIInChI=1S/C14H25N3O3/c1-15-14(19)16-6-3-11(4-7-16)12-5-8-17(9-12)13(18)10-20-2/h11-12H,3-10H2,1-2H3,(H,15,19)
InChIKeyQQGVPCDVZSYBTM-UHFFFAOYSA-N
MW283.37 g/mol
LogP0.53
Rot. Bonds3

About 4-[1-(2-methoxyacetyl)pyrrolidin-3-yl]-N-methylpiperidine-1-carboxamide

4-[1-(2-methoxyacetyl)pyrrolidin-3-yl]-N-methylpiperidine-1-carboxamide (PubChem CID 91916509) has the molecular formula C14H25N3O3 and a molecular weight of 283.37 g/mol. Its IUPAC name is 4-[1-(2-methoxyacetyl)pyrrolidin-3-yl]-N-methylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-[1-(2-methoxyacetyl)pyrrolidin-3-yl]-N-methylpiperidine-1-carboxamide
PubChem CID91916509
Molecular FormulaC14H25N3O3
Molecular Weight283.37 g/mol
Exact Mass283.19
IUPAC Name4-[1-(2-methoxyacetyl)pyrrolidin-3-yl]-N-methylpiperidine-1-carboxamide
SMILESCNC(=O)N1CCC(C2CCN(C(=O)COC)C2)CC1
InChIInChI=1S/C14H25N3O3/c1-15-14(19)16-6-3-11(4-7-16)12-5-8-17(9-12)13(18)10-20-2/h11-12H,3-10H2,1-2H3,(H,15,19)
InChIKeyQQGVPCDVZSYBTM-UHFFFAOYSA-N
XLogP0.53
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-4-[1-(2-methylsulfanylacetyl)pyrrolidin-3-yl]piperidine-1-carboxamide
CID 91921357
4-[1-[2-(4-fluorophenoxy)acetyl]pyrrolidin-3-yl]-N-methylpiperidine-1-carboxamide
CID 91921344
4-[1-(2-cyclohexylacetyl)pyrrolidin-3-yl]-N-methylpiperidine-1-carboxamide
CID 91910219
1-[(3aS,7aR)-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl]-2-methoxyethanone
CID 130657748
2-methoxy-1-[(3S)-3-methylpyrrolidin-1-yl]ethanone
CID 145013525
2-methoxy-1-[3-methyl-4-(methylamino)piperidin-1-yl]ethanone
CID 114498163
1-(3,4-dimethylpiperidin-1-yl)-2-methoxyethanone
CID 115871790
4-[1-[3-(3-methoxyphenyl)propanoyl]pyrrolidin-3-yl]-N-methylpiperidine-1-carboxamide
CID 91921363
4-[1-(4-methoxybenzoyl)pyrrolidin-3-yl]-N-methylpiperidine-1-carboxamide
CID 91921338
1-[(4aS,8aR)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-ethoxyethanone
CID 95358475
2-methoxy-1-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)ethanone
CID 81205521
1-(3-amino-4-ethylpiperidin-1-yl)-2-methoxyethanone
CID 165440680

Frequently Asked Questions

What is the IUPAC name of 4-[1-(2-methoxyacetyl)pyrrolidin-3-yl]-N-methylpiperidine-1-carboxamide?
The IUPAC name of 4-[1-(2-methoxyacetyl)pyrrolidin-3-yl]-N-methylpiperidine-1-carboxamide (CID 91916509) is 4-[1-(2-methoxyacetyl)pyrrolidin-3-yl]-N-methylpiperidine-1-carboxamide.
What is the SMILES notation for 4-[1-(2-methoxyacetyl)pyrrolidin-3-yl]-N-methylpiperidine-1-carboxamide?
The canonical SMILES for 4-[1-(2-methoxyacetyl)pyrrolidin-3-yl]-N-methylpiperidine-1-carboxamide is CNC(=O)N1CCC(C2CCN(C(=O)COC)C2)CC1.
What is the InChIKey of 4-[1-(2-methoxyacetyl)pyrrolidin-3-yl]-N-methylpiperidine-1-carboxamide?
The InChIKey is QQGVPCDVZSYBTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O3/c1-15-14(19)16-6-3-11(4-7-16)12-5-8-17(9-12)13(18)10-20-2/h11-12H,3-10H2,1-2H3,(H,15,19).
What are the key properties of 4-[1-(2-methoxyacetyl)pyrrolidin-3-yl]-N-methylpiperidine-1-carboxamide?
4-[1-(2-methoxyacetyl)pyrrolidin-3-yl]-N-methylpiperidine-1-carboxamide has a molecular weight of 283.37 g/mol, XLogP of 0.53, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(2-methoxyacetyl)pyrrolidin-3-yl]-N-methylpiperidine-1-carboxamide is sourced from PubChem (CID 91916509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).