4-[2-[4-[(3-fluoro-2-pyridinyl)methyl]morpholin-2-yl]ethyl]pyridin-2-amine

C17H21FN4O — CID 110113890

IUPAC4-[2-[4-[(3-fluoro-2-pyridinyl)methyl]morpholin-2-yl]ethyl]pyridin-2-amine
SMILESNc1cc(CCC2CN(Cc3ncccc3F)CCO2)ccn1
InChIInChI=1S/C17H21FN4O/c18-15-2-1-6-20-16(15)12-22-8-9-23-14(11-22)4-3-13-5-7-21-17(19)10-13/h1-2,5-7,10,14H,3-4,8-9,11-12H2,(H2,19,21)
InChIKeyJKVSHGDMQLXZJA-UHFFFAOYSA-N
MW316.38 g/mol
LogP2.03
Rot. Bonds5

About 4-[2-[4-[(3-fluoro-2-pyridinyl)methyl]morpholin-2-yl]ethyl]pyridin-2-amine

4-[2-[4-[(3-fluoro-2-pyridinyl)methyl]morpholin-2-yl]ethyl]pyridin-2-amine (PubChem CID 110113890) has the molecular formula C17H21FN4O and a molecular weight of 316.38 g/mol. Its IUPAC name is 4-[2-[4-[(3-fluoro-2-pyridinyl)methyl]morpholin-2-yl]ethyl]pyridin-2-amine.

Molecular Properties

Compound Name4-[2-[4-[(3-fluoro-2-pyridinyl)methyl]morpholin-2-yl]ethyl]pyridin-2-amine
PubChem CID110113890
Molecular FormulaC17H21FN4O
Molecular Weight316.38 g/mol
Exact Mass316.17
IUPAC Name4-[2-[4-[(3-fluoro-2-pyridinyl)methyl]morpholin-2-yl]ethyl]pyridin-2-amine
SMILESNc1cc(CCC2CN(Cc3ncccc3F)CCO2)ccn1
InChIInChI=1S/C17H21FN4O/c18-15-2-1-6-20-16(15)12-22-8-9-23-14(11-22)4-3-13-5-7-21-17(19)10-13/h1-2,5-7,10,14H,3-4,8-9,11-12H2,(H2,19,21)
InChIKeyJKVSHGDMQLXZJA-UHFFFAOYSA-N
XLogP2.03
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.38
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-[2-[4-[(3-fluoro-2-pyridinyl)methyl]morpholin-2-yl]ethyl]pyridin-2-amine with MolForge

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Related Compounds

4-[2-[(2R)-4-(pyridin-2-ylmethyl)morpholin-2-yl]ethyl]pyridin-2-amine
CID 124965523
3-[[2-[2-(2-amino-4-pyridinyl)ethyl]morpholin-4-yl]methyl]benzoic acid
CID 110113863
4-[2-[(2S)-4-(2-phenoxyethyl)morpholin-2-yl]ethyl]pyridin-2-amine
CID 125022970
4-[2-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholin-2-yl]ethyl]pyridin-2-amine
CID 110113875
2-[3-[[(2S)-2-[2-(2-amino-4-pyridinyl)ethyl]morpholin-4-yl]methyl]phenoxy]ethanol
CID 124963457
2-[(2S)-2-[2-(2-amino-4-pyridinyl)ethyl]morpholin-4-yl]-N,N-dimethylacetamide
CID 124957231
[2-[2-(2-amino-4-pyridinyl)ethyl]morpholin-4-yl]-pyridin-2-ylmethanone
CID 110113908
4-[2-[(2S)-4-pyridin-3-ylsulfonylmorpholin-2-yl]ethyl]pyridin-2-amine
CID 124945564
4-[2-[4-(6-methyl-2-pyridinyl)morpholin-2-yl]ethyl]pyridin-2-amine
CID 110113915
4-[2-(4-cyclohexylsulfonylmorpholin-2-yl)ethyl]pyridin-2-amine
CID 110113962
1-[2-[2-(2-amino-4-pyridinyl)ethyl]morpholin-4-yl]-3-pyridin-3-ylpropan-1-one
CID 110113956
1-[(2R)-2-[2-(2-amino-4-pyridinyl)ethyl]morpholin-4-yl]-2-(4-fluorophenoxy)ethanone
CID 125021853

Frequently Asked Questions

What is the IUPAC name of 4-[2-[4-[(3-fluoro-2-pyridinyl)methyl]morpholin-2-yl]ethyl]pyridin-2-amine?
The IUPAC name of 4-[2-[4-[(3-fluoro-2-pyridinyl)methyl]morpholin-2-yl]ethyl]pyridin-2-amine (CID 110113890) is 4-[2-[4-[(3-fluoro-2-pyridinyl)methyl]morpholin-2-yl]ethyl]pyridin-2-amine.
What is the SMILES notation for 4-[2-[4-[(3-fluoro-2-pyridinyl)methyl]morpholin-2-yl]ethyl]pyridin-2-amine?
The canonical SMILES for 4-[2-[4-[(3-fluoro-2-pyridinyl)methyl]morpholin-2-yl]ethyl]pyridin-2-amine is Nc1cc(CCC2CN(Cc3ncccc3F)CCO2)ccn1.
What is the InChIKey of 4-[2-[4-[(3-fluoro-2-pyridinyl)methyl]morpholin-2-yl]ethyl]pyridin-2-amine?
The InChIKey is JKVSHGDMQLXZJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21FN4O/c18-15-2-1-6-20-16(15)12-22-8-9-23-14(11-22)4-3-13-5-7-21-17(19)10-13/h1-2,5-7,10,14H,3-4,8-9,11-12H2,(H2,19,21).
What are the key properties of 4-[2-[4-[(3-fluoro-2-pyridinyl)methyl]morpholin-2-yl]ethyl]pyridin-2-amine?
4-[2-[4-[(3-fluoro-2-pyridinyl)methyl]morpholin-2-yl]ethyl]pyridin-2-amine has a molecular weight of 316.38 g/mol, XLogP of 2.03, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[4-[(3-fluoro-2-pyridinyl)methyl]morpholin-2-yl]ethyl]pyridin-2-amine is sourced from PubChem (CID 110113890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).