N-cyclohexyl-2-propoxyaniline

C15H23NO — CID 43682292

IUPACN-cyclohexyl-2-propoxyaniline
SMILESCCCOc1ccccc1NC1CCCCC1
InChIInChI=1S/C15H23NO/c1-2-12-17-15-11-7-6-10-14(15)16-13-8-4-3-5-9-13/h6-7,10-11,13,16H,2-5,8-9,12H2,1H3
InChIKeyNFGYGMGRPGSKPM-UHFFFAOYSA-N
MW233.35 g/mol
LogP4.22
Rot. Bonds5

About N-cyclohexyl-2-propoxyaniline

N-cyclohexyl-2-propoxyaniline (PubChem CID 43682292) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is N-cyclohexyl-2-propoxyaniline.

Molecular Properties

Compound NameN-cyclohexyl-2-propoxyaniline
PubChem CID43682292
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC NameN-cyclohexyl-2-propoxyaniline
SMILESCCCOc1ccccc1NC1CCCCC1
InChIInChI=1S/C15H23NO/c1-2-12-17-15-11-7-6-10-14(15)16-13-8-4-3-5-9-13/h6-7,10-11,13,16H,2-5,8-9,12H2,1H3
InChIKeyNFGYGMGRPGSKPM-UHFFFAOYSA-N
XLogP4.22
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-N-(2-propoxyphenyl)cyclohexane-1,4-diamine
CID 79724258
N-(3,3-dimethylcyclopentyl)-2-propoxyaniline
CID 80705624
5-chloro-N-cyclohexyl-2-propoxyaniline
CID 63453197
2-propoxy-N-(3,3,5,5-tetramethylcyclohexyl)aniline
CID 115998703
1-cyclohexyl-3-(2-propoxyphenyl)urea
CID 47103328
N-cyclopentyl-2-(2-methylpropoxy)aniline
CID 54864910
N-cyclohexyl-2-[2-(1,1-dioxothietan-3-yl)ethoxy]aniline
CID 167888778
N-[3-(2-propoxyphenoxy)propyl]cyclohexanamine
CID 62573100
N-(cyclopropylmethyl)-2-propoxyaniline
CID 43682348
2-[2-(cyclopentylamino)phenoxy]acetonitrile
CID 82932126
N-(2-propoxyphenyl)bicyclo[2.2.1]heptan-2-amine
CID 63426599
N'-(2-butoxyphenyl)-N-cyclohexylethane-1,2-diamine
CID 54809931

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-propoxyaniline?
The IUPAC name of N-cyclohexyl-2-propoxyaniline (CID 43682292) is N-cyclohexyl-2-propoxyaniline.
What is the SMILES notation for N-cyclohexyl-2-propoxyaniline?
The canonical SMILES for N-cyclohexyl-2-propoxyaniline is CCCOc1ccccc1NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-propoxyaniline?
The InChIKey is NFGYGMGRPGSKPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-2-12-17-15-11-7-6-10-14(15)16-13-8-4-3-5-9-13/h6-7,10-11,13,16H,2-5,8-9,12H2,1H3.
What are the key properties of N-cyclohexyl-2-propoxyaniline?
N-cyclohexyl-2-propoxyaniline has a molecular weight of 233.35 g/mol, XLogP of 4.22, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-propoxyaniline is sourced from PubChem (CID 43682292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).