4-tert-butyl-N-ethyl-2-(furan-2-ylmethyl)cyclohexan-1-amine

C17H29NO — CID 63401760

IUPAC4-tert-butyl-N-ethyl-2-(furan-2-ylmethyl)cyclohexan-1-amine
SMILESCCNC1CCC(C(C)(C)C)CC1Cc1ccco1
InChIInChI=1S/C17H29NO/c1-5-18-16-9-8-14(17(2,3)4)11-13(16)12-15-7-6-10-19-15/h6-7,10,13-14,16,18H,5,8-9,11-12H2,1-4H3
InChIKeyIWWDLQHTVDMSTF-UHFFFAOYSA-N
MW263.42 g/mol
LogP4.26
Rot. Bonds4

About 4-tert-butyl-N-ethyl-2-(furan-2-ylmethyl)cyclohexan-1-amine

4-tert-butyl-N-ethyl-2-(furan-2-ylmethyl)cyclohexan-1-amine (PubChem CID 63401760) has the molecular formula C17H29NO and a molecular weight of 263.42 g/mol. Its IUPAC name is 4-tert-butyl-N-ethyl-2-(furan-2-ylmethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-tert-butyl-N-ethyl-2-(furan-2-ylmethyl)cyclohexan-1-amine
PubChem CID63401760
Molecular FormulaC17H29NO
Molecular Weight263.42 g/mol
Exact Mass263.22
IUPAC Name4-tert-butyl-N-ethyl-2-(furan-2-ylmethyl)cyclohexan-1-amine
SMILESCCNC1CCC(C(C)(C)C)CC1Cc1ccco1
InChIInChI=1S/C17H29NO/c1-5-18-16-9-8-14(17(2,3)4)11-13(16)12-15-7-6-10-19-15/h6-7,10,13-14,16,18H,5,8-9,11-12H2,1-4H3
InChIKeyIWWDLQHTVDMSTF-UHFFFAOYSA-N
XLogP4.26
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.42
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-tert-butyl-N-propyl-2-(thiophen-2-ylmethyl)cyclohexan-1-amine
CID 63401632
4-tert-butyl-2-[[cyclopropyl(methyl)amino]methyl]-N-ethylcyclohexan-1-amine
CID 62614673
4-tert-butyl-N-ethyl-2-phenoxycyclohexan-1-amine
CID 63474712
4-tert-butyl-2-(diethylaminomethyl)-N-ethylcyclohexan-1-amine
CID 63483579
4-tert-butyl-N-(furan-2-ylmethyl)cycloheptan-1-amine
CID 65090187
N-ethyl-2-[[furan-2-ylmethyl(methyl)amino]methyl]-4-propan-2-ylcyclohexan-1-amine
CID 62708305
N,4-diethyl-2-(furan-2-ylmethylsulfanyl)cyclohexan-1-amine
CID 64609685
4-tert-butyl-N-ethyl-2-(4-methylphenoxy)cyclohexan-1-amine
CID 63474008
1-(4-tert-butylcyclohexyl)-2-(furan-2-yl)ethanone
CID 83171692
4-tert-butyl-N-ethyl-2-[(4-methylpiperazin-1-yl)methyl]cyclohexan-1-amine
CID 62615346
4-tert-butyl-N-ethyl-2-(3-ethylsulfonylpropyl)cyclohexan-1-amine
CID 65097873
2-(cyclobutylmethyl)furan
CID 139469251

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N-ethyl-2-(furan-2-ylmethyl)cyclohexan-1-amine?
The IUPAC name of 4-tert-butyl-N-ethyl-2-(furan-2-ylmethyl)cyclohexan-1-amine (CID 63401760) is 4-tert-butyl-N-ethyl-2-(furan-2-ylmethyl)cyclohexan-1-amine.
What is the SMILES notation for 4-tert-butyl-N-ethyl-2-(furan-2-ylmethyl)cyclohexan-1-amine?
The canonical SMILES for 4-tert-butyl-N-ethyl-2-(furan-2-ylmethyl)cyclohexan-1-amine is CCNC1CCC(C(C)(C)C)CC1Cc1ccco1.
What is the InChIKey of 4-tert-butyl-N-ethyl-2-(furan-2-ylmethyl)cyclohexan-1-amine?
The InChIKey is IWWDLQHTVDMSTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29NO/c1-5-18-16-9-8-14(17(2,3)4)11-13(16)12-15-7-6-10-19-15/h6-7,10,13-14,16,18H,5,8-9,11-12H2,1-4H3.
What are the key properties of 4-tert-butyl-N-ethyl-2-(furan-2-ylmethyl)cyclohexan-1-amine?
4-tert-butyl-N-ethyl-2-(furan-2-ylmethyl)cyclohexan-1-amine has a molecular weight of 263.42 g/mol, XLogP of 4.26, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N-ethyl-2-(furan-2-ylmethyl)cyclohexan-1-amine is sourced from PubChem (CID 63401760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).