[4-[2-(aminomethyl)-4-pyridinyl]morpholin-2-yl]methanol

C11H17N3O2 — CID 81205345

IUPAC[4-[2-(aminomethyl)-4-pyridinyl]morpholin-2-yl]methanol
SMILESNCc1cc(N2CCOC(CO)C2)ccn1
InChIInChI=1S/C11H17N3O2/c12-6-9-5-10(1-2-13-9)14-3-4-16-11(7-14)8-15/h1-2,5,11,15H,3-4,6-8,12H2
InChIKeyAFMMLWSPBLCBPJ-UHFFFAOYSA-N
MW223.28 g/mol
LogP-0.26
Rot. Bonds3

About [4-[2-(aminomethyl)-4-pyridinyl]morpholin-2-yl]methanol

[4-[2-(aminomethyl)-4-pyridinyl]morpholin-2-yl]methanol (PubChem CID 81205345) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is [4-[2-(aminomethyl)-4-pyridinyl]morpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[2-(aminomethyl)-4-pyridinyl]morpholin-2-yl]methanol
PubChem CID81205345
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name[4-[2-(aminomethyl)-4-pyridinyl]morpholin-2-yl]methanol
SMILESNCc1cc(N2CCOC(CO)C2)ccn1
InChIInChI=1S/C11H17N3O2/c12-6-9-5-10(1-2-13-9)14-3-4-16-11(7-14)8-15/h1-2,5,11,15H,3-4,6-8,12H2
InChIKeyAFMMLWSPBLCBPJ-UHFFFAOYSA-N
XLogP-0.26
TPSA71.61 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-[2-(aminomethyl)-4-pyridinyl]morpholin-2-yl]methanol?
The IUPAC name of [4-[2-(aminomethyl)-4-pyridinyl]morpholin-2-yl]methanol (CID 81205345) is [4-[2-(aminomethyl)-4-pyridinyl]morpholin-2-yl]methanol.
What is the SMILES notation for [4-[2-(aminomethyl)-4-pyridinyl]morpholin-2-yl]methanol?
The canonical SMILES for [4-[2-(aminomethyl)-4-pyridinyl]morpholin-2-yl]methanol is NCc1cc(N2CCOC(CO)C2)ccn1.
What is the InChIKey of [4-[2-(aminomethyl)-4-pyridinyl]morpholin-2-yl]methanol?
The InChIKey is AFMMLWSPBLCBPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c12-6-9-5-10(1-2-13-9)14-3-4-16-11(7-14)8-15/h1-2,5,11,15H,3-4,6-8,12H2.
What are the key properties of [4-[2-(aminomethyl)-4-pyridinyl]morpholin-2-yl]methanol?
[4-[2-(aminomethyl)-4-pyridinyl]morpholin-2-yl]methanol has a molecular weight of 223.28 g/mol, XLogP of -0.26, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-(aminomethyl)-4-pyridinyl]morpholin-2-yl]methanol is sourced from PubChem (CID 81205345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).