4-(anilinomethyl)piperidin-4-ol

C12H18N2O — CID 56773843

IUPAC4-(anilinomethyl)piperidin-4-ol
SMILESOC1(CNc2ccccc2)CCNCC1
InChIInChI=1S/C12H18N2O/c15-12(6-8-13-9-7-12)10-14-11-4-2-1-3-5-11/h1-5,13-15H,6-10H2
InChIKeyBGZVNEQHXCWLLO-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.21
Rot. Bonds3

About 4-(anilinomethyl)piperidin-4-ol

4-(anilinomethyl)piperidin-4-ol (PubChem CID 56773843) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 4-(anilinomethyl)piperidin-4-ol.

Molecular Properties

Compound Name4-(anilinomethyl)piperidin-4-ol
PubChem CID56773843
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name4-(anilinomethyl)piperidin-4-ol
SMILESOC1(CNc2ccccc2)CCNCC1
InChIInChI=1S/C12H18N2O/c15-12(6-8-13-9-7-12)10-14-11-4-2-1-3-5-11/h1-5,13-15H,6-10H2
InChIKeyBGZVNEQHXCWLLO-UHFFFAOYSA-N
XLogP1.21
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(anilinomethyl)piperidin-4-ol?
The IUPAC name of 4-(anilinomethyl)piperidin-4-ol (CID 56773843) is 4-(anilinomethyl)piperidin-4-ol.
What is the SMILES notation for 4-(anilinomethyl)piperidin-4-ol?
The canonical SMILES for 4-(anilinomethyl)piperidin-4-ol is OC1(CNc2ccccc2)CCNCC1.
What is the InChIKey of 4-(anilinomethyl)piperidin-4-ol?
The InChIKey is BGZVNEQHXCWLLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c15-12(6-8-13-9-7-12)10-14-11-4-2-1-3-5-11/h1-5,13-15H,6-10H2.
What are the key properties of 4-(anilinomethyl)piperidin-4-ol?
4-(anilinomethyl)piperidin-4-ol has a molecular weight of 206.29 g/mol, XLogP of 1.21, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(anilinomethyl)piperidin-4-ol is sourced from PubChem (CID 56773843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).