N-(3-methoxyphenyl)piperidin-4-amine

C12H18N2O — CID 7148673

IUPACN-(3-methoxyphenyl)piperidin-4-amine
SMILESCOc1cccc(NC2CCNCC2)c1
InChIInChI=1S/C12H18N2O/c1-15-12-4-2-3-11(9-12)14-10-5-7-13-8-6-10/h2-4,9-10,13-14H,5-8H2,1H3
InChIKeyTWBBGXRQAIQTFK-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.86
Rot. Bonds3

About N-(3-methoxyphenyl)piperidin-4-amine

N-(3-methoxyphenyl)piperidin-4-amine (PubChem CID 7148673) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is N-(3-methoxyphenyl)piperidin-4-amine.

Molecular Properties

Compound NameN-(3-methoxyphenyl)piperidin-4-amine
PubChem CID7148673
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC NameN-(3-methoxyphenyl)piperidin-4-amine
SMILESCOc1cccc(NC2CCNCC2)c1
InChIInChI=1S/C12H18N2O/c1-15-12-4-2-3-11(9-12)14-10-5-7-13-8-6-10/h2-4,9-10,13-14H,5-8H2,1H3
InChIKeyTWBBGXRQAIQTFK-UHFFFAOYSA-N
XLogP1.86
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)piperidin-4-amine?
The IUPAC name of N-(3-methoxyphenyl)piperidin-4-amine (CID 7148673) is N-(3-methoxyphenyl)piperidin-4-amine.
What is the SMILES notation for N-(3-methoxyphenyl)piperidin-4-amine?
The canonical SMILES for N-(3-methoxyphenyl)piperidin-4-amine is COc1cccc(NC2CCNCC2)c1.
What is the InChIKey of N-(3-methoxyphenyl)piperidin-4-amine?
The InChIKey is TWBBGXRQAIQTFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-15-12-4-2-3-11(9-12)14-10-5-7-13-8-6-10/h2-4,9-10,13-14H,5-8H2,1H3.
What are the key properties of N-(3-methoxyphenyl)piperidin-4-amine?
N-(3-methoxyphenyl)piperidin-4-amine has a molecular weight of 206.29 g/mol, XLogP of 1.86, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)piperidin-4-amine is sourced from PubChem (CID 7148673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).