(2-cyclobutyloxy-6-piperidin-1-ylphenyl)methanamine

C16H24N2O — CID 118156691

IUPAC(2-cyclobutyloxy-6-piperidin-1-ylphenyl)methanamine
SMILESNCc1c(OC2CCC2)cccc1N1CCCCC1
InChIInChI=1S/C16H24N2O/c17-12-14-15(18-10-2-1-3-11-18)8-5-9-16(14)19-13-6-4-7-13/h5,8-9,13H,1-4,6-7,10-12,17H2
InChIKeyUVXXGCIRPNAEKW-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.07
Rot. Bonds4

About (2-cyclobutyloxy-6-piperidin-1-ylphenyl)methanamine

(2-cyclobutyloxy-6-piperidin-1-ylphenyl)methanamine (PubChem CID 118156691) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is (2-cyclobutyloxy-6-piperidin-1-ylphenyl)methanamine.

Molecular Properties

Compound Name(2-cyclobutyloxy-6-piperidin-1-ylphenyl)methanamine
PubChem CID118156691
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name(2-cyclobutyloxy-6-piperidin-1-ylphenyl)methanamine
SMILESNCc1c(OC2CCC2)cccc1N1CCCCC1
InChIInChI=1S/C16H24N2O/c17-12-14-15(18-10-2-1-3-11-18)8-5-9-16(14)19-13-6-4-7-13/h5,8-9,13H,1-4,6-7,10-12,17H2
InChIKeyUVXXGCIRPNAEKW-UHFFFAOYSA-N
XLogP3.07
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(2-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine
CID 118156701
[2-(azocan-1-yl)-6-chlorophenyl]methanamine
CID 28965332
[2-(3-methoxyphenoxy)-6-piperidin-1-ylphenyl]methanamine
CID 118156697
[2-(azepan-1-yl)-6-[4-(trifluoromethoxy)phenoxy]phenyl]methanamine
CID 118156652
[2-[4-[[3-(aminomethyl)-4-[4-[3-(aminomethyl)-4-pyrrolidin-1-yl-2-(trifluoromethyl)phenoxy]piperidin-1-yl]-2-(trifluoromethyl)phenyl]methoxy]piperidin-1-yl]-6-(trifluoromethyl)phenyl]methanamine
CID 123634203
1-(2-cycloheptyloxyphenyl)-1,4-diazepane
CID 82925695
1-(2-phenylethylsulfonyl)-4-(2-piperidin-1-ylphenoxy)piperidine
CID 174483108
2-(2-fluoro-6-piperidin-1-ylphenyl)ethanamine
CID 82286983
2-[2-(azepan-1-yl)-6-fluorophenyl]ethanamine
CID 82291720
[2-chloro-6-(4,4-dimethylazepan-1-yl)phenyl]methanamine
CID 65283852
1-(3-methoxy-2-prop-2-enylphenyl)piperidine
CID 101476464
1,2-dicyclohexyloxybenzene
CID 67331328

Frequently Asked Questions

What is the IUPAC name of (2-cyclobutyloxy-6-piperidin-1-ylphenyl)methanamine?
The IUPAC name of (2-cyclobutyloxy-6-piperidin-1-ylphenyl)methanamine (CID 118156691) is (2-cyclobutyloxy-6-piperidin-1-ylphenyl)methanamine.
What is the SMILES notation for (2-cyclobutyloxy-6-piperidin-1-ylphenyl)methanamine?
The canonical SMILES for (2-cyclobutyloxy-6-piperidin-1-ylphenyl)methanamine is NCc1c(OC2CCC2)cccc1N1CCCCC1.
What is the InChIKey of (2-cyclobutyloxy-6-piperidin-1-ylphenyl)methanamine?
The InChIKey is UVXXGCIRPNAEKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c17-12-14-15(18-10-2-1-3-11-18)8-5-9-16(14)19-13-6-4-7-13/h5,8-9,13H,1-4,6-7,10-12,17H2.
What are the key properties of (2-cyclobutyloxy-6-piperidin-1-ylphenyl)methanamine?
(2-cyclobutyloxy-6-piperidin-1-ylphenyl)methanamine has a molecular weight of 260.38 g/mol, XLogP of 3.07, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclobutyloxy-6-piperidin-1-ylphenyl)methanamine is sourced from PubChem (CID 118156691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).