N-methyl-2-morpholin-4-yl-2-pyridin-3-ylethanamine

C12H19N3O — CID 44784942

IUPACN-methyl-2-morpholin-4-yl-2-pyridin-3-ylethanamine
SMILESCNCC(c1cccnc1)N1CCOCC1
InChIInChI=1S/C12H19N3O/c1-13-10-12(11-3-2-4-14-9-11)15-5-7-16-8-6-15/h2-4,9,12-13H,5-8,10H2,1H3
InChIKeyFXECCSGVHLYOKI-UHFFFAOYSA-N
MW221.30 g/mol
LogP0.67
Rot. Bonds4

About N-methyl-2-morpholin-4-yl-2-pyridin-3-ylethanamine

N-methyl-2-morpholin-4-yl-2-pyridin-3-ylethanamine (PubChem CID 44784942) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N-methyl-2-morpholin-4-yl-2-pyridin-3-ylethanamine.

Molecular Properties

Compound NameN-methyl-2-morpholin-4-yl-2-pyridin-3-ylethanamine
PubChem CID44784942
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN-methyl-2-morpholin-4-yl-2-pyridin-3-ylethanamine
SMILESCNCC(c1cccnc1)N1CCOCC1
InChIInChI=1S/C12H19N3O/c1-13-10-12(11-3-2-4-14-9-11)15-5-7-16-8-6-15/h2-4,9,12-13H,5-8,10H2,1H3
InChIKeyFXECCSGVHLYOKI-UHFFFAOYSA-N
XLogP0.67
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-morpholin-4-yl-2-pyridin-3-ylethanamine?
The IUPAC name of N-methyl-2-morpholin-4-yl-2-pyridin-3-ylethanamine (CID 44784942) is N-methyl-2-morpholin-4-yl-2-pyridin-3-ylethanamine.
What is the SMILES notation for N-methyl-2-morpholin-4-yl-2-pyridin-3-ylethanamine?
The canonical SMILES for N-methyl-2-morpholin-4-yl-2-pyridin-3-ylethanamine is CNCC(c1cccnc1)N1CCOCC1.
What is the InChIKey of N-methyl-2-morpholin-4-yl-2-pyridin-3-ylethanamine?
The InChIKey is FXECCSGVHLYOKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-13-10-12(11-3-2-4-14-9-11)15-5-7-16-8-6-15/h2-4,9,12-13H,5-8,10H2,1H3.
What are the key properties of N-methyl-2-morpholin-4-yl-2-pyridin-3-ylethanamine?
N-methyl-2-morpholin-4-yl-2-pyridin-3-ylethanamine has a molecular weight of 221.30 g/mol, XLogP of 0.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-morpholin-4-yl-2-pyridin-3-ylethanamine is sourced from PubChem (CID 44784942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).