2-methylpropyl N-(2-piperidin-4-yloxyethyl)carbamate

C12H24N2O3 — CID 63871589

IUPAC2-methylpropyl N-(2-piperidin-4-yloxyethyl)carbamate
SMILESCC(C)COC(=O)NCCOC1CCNCC1
InChIInChI=1S/C12H24N2O3/c1-10(2)9-17-12(15)14-7-8-16-11-3-5-13-6-4-11/h10-11,13H,3-9H2,1-2H3,(H,14,15)
InChIKeyLXIFXCVKIRDTSU-UHFFFAOYSA-N
MW244.33 g/mol
LogP1.14
Rot. Bonds6

About 2-methylpropyl N-(2-piperidin-4-yloxyethyl)carbamate

2-methylpropyl N-(2-piperidin-4-yloxyethyl)carbamate (PubChem CID 63871589) has the molecular formula C12H24N2O3 and a molecular weight of 244.33 g/mol. Its IUPAC name is 2-methylpropyl N-(2-piperidin-4-yloxyethyl)carbamate.

Molecular Properties

Compound Name2-methylpropyl N-(2-piperidin-4-yloxyethyl)carbamate
PubChem CID63871589
Molecular FormulaC12H24N2O3
Molecular Weight244.33 g/mol
Exact Mass244.18
IUPAC Name2-methylpropyl N-(2-piperidin-4-yloxyethyl)carbamate
SMILESCC(C)COC(=O)NCCOC1CCNCC1
InChIInChI=1S/C12H24N2O3/c1-10(2)9-17-12(15)14-7-8-16-11-3-5-13-6-4-11/h10-11,13H,3-9H2,1-2H3,(H,14,15)
InChIKeyLXIFXCVKIRDTSU-UHFFFAOYSA-N
XLogP1.14
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-methylpropyl 3-piperidin-4-yloxypropanoate
CID 63869912
2-methylpropyl N-[3-(4-aminocyclohexyl)oxypropyl]carbamate
CID 63870091
3,4,4-trimethyl-N-(2-piperidin-4-yloxyethyl)pentanamide
CID 55251825
1,1-diethyl-3-(2-piperidin-4-yloxyethyl)urea
CID 79161980
2-methylpropyl N-(pyrrolidin-3-ylmethyl)carbamate
CID 80563571
1-butyl-3-(2-piperidin-4-yloxyethyl)urea
CID 55252329
2-methylpropyl N-[6-(2-methylpropoxycarbonylamino)hexyl]carbamate
CID 91749295
2,2,2-trifluoro-N-(2-piperidin-4-yloxyethyl)acetamide
CID 63869260
2-methylpropyl N-[2-(methylamino)ethyl]carbamate
CID 62658921
2-methyl-N-[2-(3-piperidin-4-yloxypropanoylamino)ethyl]propanamide
CID 63904487
2-methyl-N-(2-piperidin-4-yloxyethyl)propan-1-amine
CID 63903400
N-(2-piperidin-4-yloxyethyl)cyclopent-3-ene-1-carboxamide
CID 64767379

Frequently Asked Questions

What is the IUPAC name of 2-methylpropyl N-(2-piperidin-4-yloxyethyl)carbamate?
The IUPAC name of 2-methylpropyl N-(2-piperidin-4-yloxyethyl)carbamate (CID 63871589) is 2-methylpropyl N-(2-piperidin-4-yloxyethyl)carbamate.
What is the SMILES notation for 2-methylpropyl N-(2-piperidin-4-yloxyethyl)carbamate?
The canonical SMILES for 2-methylpropyl N-(2-piperidin-4-yloxyethyl)carbamate is CC(C)COC(=O)NCCOC1CCNCC1.
What is the InChIKey of 2-methylpropyl N-(2-piperidin-4-yloxyethyl)carbamate?
The InChIKey is LXIFXCVKIRDTSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3/c1-10(2)9-17-12(15)14-7-8-16-11-3-5-13-6-4-11/h10-11,13H,3-9H2,1-2H3,(H,14,15).
What are the key properties of 2-methylpropyl N-(2-piperidin-4-yloxyethyl)carbamate?
2-methylpropyl N-(2-piperidin-4-yloxyethyl)carbamate has a molecular weight of 244.33 g/mol, XLogP of 1.14, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpropyl N-(2-piperidin-4-yloxyethyl)carbamate is sourced from PubChem (CID 63871589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).