methyl N-(4-piperidin-1-ylbutyl)carbamate

C11H22N2O2 — CID 97356284

IUPACmethyl N-(4-piperidin-1-ylbutyl)carbamate
SMILESCOC(=O)NCCCCN1CCCCC1
InChIInChI=1S/C11H22N2O2/c1-15-11(14)12-7-3-6-10-13-8-4-2-5-9-13/h2-10H2,1H3,(H,12,14)
InChIKeyDRZNASKNMJMONT-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.61
Rot. Bonds5

About methyl N-(4-piperidin-1-ylbutyl)carbamate

methyl N-(4-piperidin-1-ylbutyl)carbamate (PubChem CID 97356284) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is methyl N-(4-piperidin-1-ylbutyl)carbamate.

Molecular Properties

Compound Namemethyl N-(4-piperidin-1-ylbutyl)carbamate
PubChem CID97356284
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Namemethyl N-(4-piperidin-1-ylbutyl)carbamate
SMILESCOC(=O)NCCCCN1CCCCC1
InChIInChI=1S/C11H22N2O2/c1-15-11(14)12-7-3-6-10-13-8-4-2-5-9-13/h2-10H2,1H3,(H,12,14)
InChIKeyDRZNASKNMJMONT-UHFFFAOYSA-N
XLogP1.61
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-piperidin-1-ylpropyl N-[6-(3-piperidin-1-ylpropoxycarbonylamino)hexyl]carbamate
CID 156847315
2-methoxy-N-(4-piperidin-1-ylbutyl)acetamide
CID 110443559
3-pyrrolidin-1-ylpropyl N-[6-(3-pyrrolidin-1-ylpropoxycarbonylamino)hexyl]carbamate
CID 156847303
N-[5-(azepan-1-yl)pentyl]acetamide
CID 110441166
3-piperidin-1-ylpropyl N-octylcarbamate
CID 11417860
methyl N-[4-(methoxycarbonylamino)butyl]carbamate
CID 2255932
N-[5-(azepan-1-yl)pentyl]-2-methylpropanamide
CID 110441883
tert-butyl N-[5-[4-[5-[(2-methylpropan-2-yl)oxycarbonylamino]pentyl]piperazin-1-yl]pentyl]carbamate
CID 68676140
1-pentyl-3-(6-piperidin-1-ylhexyl)urea
CID 58599050
methyl N-[10-(methoxycarbonylamino)decyl]carbamate
CID 54285968
1-(4-chlorophenyl)sulfonylpiperidine;ethane;methyl N-(3-pyrrolidin-1-ylpropyl)carbamate
CID 142272873
2-oxo-N-(3-piperidin-1-ylpropyl)propanamide
CID 121311935

Frequently Asked Questions

What is the IUPAC name of methyl N-(4-piperidin-1-ylbutyl)carbamate?
The IUPAC name of methyl N-(4-piperidin-1-ylbutyl)carbamate (CID 97356284) is methyl N-(4-piperidin-1-ylbutyl)carbamate.
What is the SMILES notation for methyl N-(4-piperidin-1-ylbutyl)carbamate?
The canonical SMILES for methyl N-(4-piperidin-1-ylbutyl)carbamate is COC(=O)NCCCCN1CCCCC1.
What is the InChIKey of methyl N-(4-piperidin-1-ylbutyl)carbamate?
The InChIKey is DRZNASKNMJMONT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-15-11(14)12-7-3-6-10-13-8-4-2-5-9-13/h2-10H2,1H3,(H,12,14).
What are the key properties of methyl N-(4-piperidin-1-ylbutyl)carbamate?
methyl N-(4-piperidin-1-ylbutyl)carbamate has a molecular weight of 214.31 g/mol, XLogP of 1.61, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-(4-piperidin-1-ylbutyl)carbamate is sourced from PubChem (CID 97356284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).