1-(cyclobutylmethyl)-N-(methoxymethyl)piperidine-3-carboxamide

C13H24N2O2 — CID 170901296

IUPAC1-(cyclobutylmethyl)-N-(methoxymethyl)piperidine-3-carboxamide
SMILESCOCNC(=O)C1CCCN(CC2CCC2)C1
InChIInChI=1S/C13H24N2O2/c1-17-10-14-13(16)12-6-3-7-15(9-12)8-11-4-2-5-11/h11-12H,2-10H2,1H3,(H,14,16)
InChIKeyBEBAXNBRVWJQJX-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.22
Rot. Bonds5

About 1-(cyclobutylmethyl)-N-(methoxymethyl)piperidine-3-carboxamide

1-(cyclobutylmethyl)-N-(methoxymethyl)piperidine-3-carboxamide (PubChem CID 170901296) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 1-(cyclobutylmethyl)-N-(methoxymethyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(cyclobutylmethyl)-N-(methoxymethyl)piperidine-3-carboxamide
PubChem CID170901296
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name1-(cyclobutylmethyl)-N-(methoxymethyl)piperidine-3-carboxamide
SMILESCOCNC(=O)C1CCCN(CC2CCC2)C1
InChIInChI=1S/C13H24N2O2/c1-17-10-14-13(16)12-6-3-7-15(9-12)8-11-4-2-5-11/h11-12H,2-10H2,1H3,(H,14,16)
InChIKeyBEBAXNBRVWJQJX-UHFFFAOYSA-N
XLogP1.22
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

methyl 1-(cyclopentylmethyl)piperidine-3-carboxylate
CID 78921285
(3R)-1-(cyclohexylmethyl)piperidine-3-carbohydrazide
CID 26188676
1-(cyclohexylmethyl)piperidine-3-carbohydrazide
CID 45075063
(3S)-1-(cyclopentylmethyl)piperidine-3-carboxylic acid
CID 51441057
ethyl (3R)-1-(cyclopropylmethyl)piperidine-3-carboxylate
CID 81338188
1-(cyclopropylmethyl)piperidine-3-carboxylic acid;hydrochloride
CID 53393263
1-(2-methoxyethyl)-N-methylpiperidine-3-carboxamide
CID 143767660
N-(cyclopropylmethyl)-1-[2-[methyl(propan-2-yl)amino]-2-oxoethyl]piperidine-3-carboxamide
CID 86993577
methyl 1-(cyclobutylmethyl)piperidine-4-carboxylate
CID 65462250
1-(2-hydroxy-2-methylpropyl)-N-(methoxymethyl)azetidine-3-carboxamide
CID 174921222
methyl (2S)-3-[(3S)-3-(cyclopropylmethylcarbamoyl)piperidin-1-yl]-2-hydroxy-2-methylpropanoate
CID 100620951
1-[(4-tert-butylcyclohexyl)methyl]piperidine-3-carboxylic acid
CID 104576017

Frequently Asked Questions

What is the IUPAC name of 1-(cyclobutylmethyl)-N-(methoxymethyl)piperidine-3-carboxamide?
The IUPAC name of 1-(cyclobutylmethyl)-N-(methoxymethyl)piperidine-3-carboxamide (CID 170901296) is 1-(cyclobutylmethyl)-N-(methoxymethyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(cyclobutylmethyl)-N-(methoxymethyl)piperidine-3-carboxamide?
The canonical SMILES for 1-(cyclobutylmethyl)-N-(methoxymethyl)piperidine-3-carboxamide is COCNC(=O)C1CCCN(CC2CCC2)C1.
What is the InChIKey of 1-(cyclobutylmethyl)-N-(methoxymethyl)piperidine-3-carboxamide?
The InChIKey is BEBAXNBRVWJQJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-17-10-14-13(16)12-6-3-7-15(9-12)8-11-4-2-5-11/h11-12H,2-10H2,1H3,(H,14,16).
What are the key properties of 1-(cyclobutylmethyl)-N-(methoxymethyl)piperidine-3-carboxamide?
1-(cyclobutylmethyl)-N-(methoxymethyl)piperidine-3-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 1.22, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclobutylmethyl)-N-(methoxymethyl)piperidine-3-carboxamide is sourced from PubChem (CID 170901296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).