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

C15H29N3O2 — CID 56825540

IUPACN-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-4-methylpiperidine-1-carboxamide
SMILESCOCCN1CCC(CNC(=O)N2CCC(C)CC2)C1
InChIInChI=1S/C15H29N3O2/c1-13-3-7-18(8-4-13)15(19)16-11-14-5-6-17(12-14)9-10-20-2/h13-14H,3-12H2,1-2H3,(H,16,19)
InChIKeyDUBCYORCTVCUEX-UHFFFAOYSA-N
MW283.42 g/mol
LogP1.40
Rot. Bonds5

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

N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-4-methylpiperidine-1-carboxamide (PubChem CID 56825540) has the molecular formula C15H29N3O2 and a molecular weight of 283.42 g/mol. Its IUPAC name is N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-4-methylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-4-methylpiperidine-1-carboxamide
PubChem CID56825540
Molecular FormulaC15H29N3O2
Molecular Weight283.42 g/mol
Exact Mass283.23
IUPAC NameN-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-4-methylpiperidine-1-carboxamide
SMILESCOCCN1CCC(CNC(=O)N2CCC(C)CC2)C1
InChIInChI=1S/C15H29N3O2/c1-13-3-7-18(8-4-13)15(19)16-11-14-5-6-17(12-14)9-10-20-2/h13-14H,3-12H2,1-2H3,(H,16,19)
InChIKeyDUBCYORCTVCUEX-UHFFFAOYSA-N
XLogP1.40
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-4-methylpiperidine-1-carboxamide?
The IUPAC name of N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-4-methylpiperidine-1-carboxamide (CID 56825540) is N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-4-methylpiperidine-1-carboxamide.
What is the SMILES notation for N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-4-methylpiperidine-1-carboxamide?
The canonical SMILES for N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-4-methylpiperidine-1-carboxamide is COCCN1CCC(CNC(=O)N2CCC(C)CC2)C1.
What is the InChIKey of N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-4-methylpiperidine-1-carboxamide?
The InChIKey is DUBCYORCTVCUEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O2/c1-13-3-7-18(8-4-13)15(19)16-11-14-5-6-17(12-14)9-10-20-2/h13-14H,3-12H2,1-2H3,(H,16,19).
What are the key properties of N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-4-methylpiperidine-1-carboxamide?
N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-4-methylpiperidine-1-carboxamide has a molecular weight of 283.42 g/mol, XLogP of 1.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-4-methylpiperidine-1-carboxamide is sourced from PubChem (CID 56825540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).