Tert-butyl N-[4-(ethylamino)cyclohexyl]carbamate

Name: Tert-butyl N-[4-(ethylamino)cyclohexyl]carbamate — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₃H₂₆N₂O₂ — CID 59201756

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPACtert-butyl N-[4-(ethylamino)cyclohexyl]carbamate

SMILESCCNC1CCC(NC(=O)OC(C)(C)C)CC1

InChIInChI=1S/C13H26N2O2/c1-5-14-10-6-8-11(9-7-10)15-12(16)17-13(2,3)4/h10-11,14H,5-9H2,1-4H3,(H,15,16)

InChIKeyCENLFVKCFRNZIL-UHFFFAOYSA-N

MW242.36 g/mol

LogP2.43

Rot. Bonds3

About Tert-butyl N-[4-(ethylamino)cyclohexyl]carbamate

Tert-butyl N-[4-(ethylamino)cyclohexyl]carbamate (PubChem CID 59201756) has the molecular formula C₁₃H₂₆N₂O₂ and a molecular weight of 242.36 g/mol. Its IUPAC name is tert-butyl N-[4-(ethylamino)cyclohexyl]carbamate.

Molecular Properties

Compound Name	Tert-butyl N-[4-(ethylamino)cyclohexyl]carbamate
PubChem CID	59201756
Molecular Formula	C₁₃H₂₆N₂O₂
Molecular Weight	242.36 g/mol
Exact Mass	242.20
IUPAC Name	tert-butyl N-[4-(ethylamino)cyclohexyl]carbamate
SMILES	CCNC1CCC(NC(=O)OC(C)(C)C)CC1
InChI	InChI=1S/C13H26N2O2/c1-5-14-10-6-8-11(9-7-10)15-12(16)17-13(2,3)4/h10-11,14H,5-9H2,1-4H3,(H,15,16)
InChIKey	CENLFVKCFRNZIL-UHFFFAOYSA-N
XLogP	2.43
TPSA	50.36 Å²
H-Bond Donors	2
H-Bond Acceptors	3
Rotatable Bonds	3
Heavy Atoms	17
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	242.36
LogP ≤ 5	2.43
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of Tert-butyl N-[4-(ethylamino)cyclohexyl]carbamate?

The IUPAC name of Tert-butyl N-[4-(ethylamino)cyclohexyl]carbamate (CID 59201756) is tert-butyl N-[4-(ethylamino)cyclohexyl]carbamate.

What is the SMILES notation for Tert-butyl N-[4-(ethylamino)cyclohexyl]carbamate?

The canonical SMILES for Tert-butyl N-[4-(ethylamino)cyclohexyl]carbamate is CCNC1CCC(NC(=O)OC(C)(C)C)CC1.

What is the InChIKey of Tert-butyl N-[4-(ethylamino)cyclohexyl]carbamate?

The InChIKey is CENLFVKCFRNZIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-5-14-10-6-8-11(9-7-10)15-12(16)17-13(2,3)4/h10-11,14H,5-9H2,1-4H3,(H,15,16).

What are the key properties of Tert-butyl N-[4-(ethylamino)cyclohexyl]carbamate?

Tert-butyl N-[4-(ethylamino)cyclohexyl]carbamate has a molecular weight of 242.36 g/mol, XLogP of 2.43, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for Tert-butyl N-[4-(ethylamino)cyclohexyl]carbamate is sourced from PubChem (CID 59201756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 59201756 — identifiers, structure, computed properties (public domain)

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