6-[(2S)-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine

C17H25N5O — CID 124944325

IUPAC6-[(2S)-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine
SMILESCCn1cc(CN2CCO[C@H](c3cccc(NC)n3)C2)c(C)n1
InChIInChI=1S/C17H25N5O/c1-4-22-11-14(13(2)20-22)10-21-8-9-23-16(12-21)15-6-5-7-17(18-3)19-15/h5-7,11,16H,4,8-10,12H2,1-3H3,(H,18,19)/t16-/m0/s1
InChIKeyBIVOJLDJCJAGFN-INIZCTEOSA-N
MW315.42 g/mol
LogP2.22
Rot. Bonds5

About 6-[(2S)-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine

6-[(2S)-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine (PubChem CID 124944325) has the molecular formula C17H25N5O and a molecular weight of 315.42 g/mol. Its IUPAC name is 6-[(2S)-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine.

Molecular Properties

Compound Name6-[(2S)-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine
PubChem CID124944325
Molecular FormulaC17H25N5O
Molecular Weight315.42 g/mol
Exact Mass315.21
IUPAC Name6-[(2S)-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine
SMILESCCn1cc(CN2CCO[C@H](c3cccc(NC)n3)C2)c(C)n1
InChIInChI=1S/C17H25N5O/c1-4-22-11-14(13(2)20-22)10-21-8-9-23-16(12-21)15-6-5-7-17(18-3)19-15/h5-7,11,16H,4,8-10,12H2,1-3H3,(H,18,19)/t16-/m0/s1
InChIKeyBIVOJLDJCJAGFN-INIZCTEOSA-N
XLogP2.22
TPSA55.21 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[6-[(3-chlorophenyl)methyl]-2-pyridinyl]-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]morpholine
CID 127250042
3-[6-[(2R)-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]morpholin-2-yl]-2-pyridinyl]benzamide
CID 124947759
N-methyl-6-[(2R)-4-[(6-methyl-2-pyridinyl)methyl]morpholin-2-yl]pyridin-2-amine
CID 124972365
N-methyl-6-[(2R)-4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholin-2-yl]pyridin-2-amine
CID 124957898
6-[4-[(2-methoxypyrimidin-5-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine
CID 110112420
6-[4-[(2-fluoro-3-methoxyphenyl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine
CID 110112505
(2S)-2-[5-[2-(4-chlorophenoxy)ethyl]-1H-pyrazol-3-yl]-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]morpholine
CID 124945699
N-methyl-6-[(2R)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholin-2-yl]pyridin-2-amine
CID 125027230
N-[6-[(2R)-4-[(1,5-dimethylpyrazol-4-yl)methyl]morpholin-2-yl]-2-pyridinyl]-4,5-dimethyl-1,3-thiazol-2-amine
CID 124943201
4-[(1,3-dimethylpyrazol-4-yl)methyl]-2-[6-(4-methoxyphenyl)-2-pyridinyl]morpholine
CID 127250503
5-ethyl-N-[6-[(2R)-4-[(2-methylphenyl)methyl]morpholin-2-yl]-2-pyridinyl]-1,3,4-thiadiazol-2-amine
CID 125016543
4,5-dimethyl-N-[6-[4-[(2-methyl-1,3-thiazol-5-yl)methyl]morpholin-2-yl]-2-pyridinyl]-1,3-thiazol-2-amine
CID 110093061

Frequently Asked Questions

What is the IUPAC name of 6-[(2S)-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine?
The IUPAC name of 6-[(2S)-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine (CID 124944325) is 6-[(2S)-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine.
What is the SMILES notation for 6-[(2S)-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine?
The canonical SMILES for 6-[(2S)-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine is CCn1cc(CN2CCO[C@H](c3cccc(NC)n3)C2)c(C)n1.
What is the InChIKey of 6-[(2S)-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine?
The InChIKey is BIVOJLDJCJAGFN-INIZCTEOSA-N. The full InChI is InChI=1S/C17H25N5O/c1-4-22-11-14(13(2)20-22)10-21-8-9-23-16(12-21)15-6-5-7-17(18-3)19-15/h5-7,11,16H,4,8-10,12H2,1-3H3,(H,18,19)/t16-/m0/s1.
What are the key properties of 6-[(2S)-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine?
6-[(2S)-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine has a molecular weight of 315.42 g/mol, XLogP of 2.22, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2S)-4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine is sourced from PubChem (CID 124944325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).