N-[6-[4-[[2-ethoxy-5-(methoxymethyl)phenyl]methyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine

C24H29N5O3 — CID 110093053

IUPACN-[6-[4-[[2-ethoxy-5-(methoxymethyl)phenyl]methyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine
SMILESCCOc1ccc(COC)cc1CN1CCOC(c2cccc(Nc3cnccn3)n2)C1
InChIInChI=1S/C24H29N5O3/c1-3-31-21-8-7-18(17-30-2)13-19(21)15-29-11-12-32-22(16-29)20-5-4-6-23(27-20)28-24-14-25-9-10-26-24/h4-10,13-14,22H,3,11-12,15-17H2,1-2H3,(H,26,27,28)
InChIKeyVNXYSPJDYPQRGG-UHFFFAOYSA-N
MW435.53 g/mol
LogP3.73
Rot. Bonds9

About N-[6-[4-[[2-ethoxy-5-(methoxymethyl)phenyl]methyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine

N-[6-[4-[[2-ethoxy-5-(methoxymethyl)phenyl]methyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine (PubChem CID 110093053) has the molecular formula C24H29N5O3 and a molecular weight of 435.53 g/mol. Its IUPAC name is N-[6-[4-[[2-ethoxy-5-(methoxymethyl)phenyl]methyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-[6-[4-[[2-ethoxy-5-(methoxymethyl)phenyl]methyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine
PubChem CID110093053
Molecular FormulaC24H29N5O3
Molecular Weight435.53 g/mol
Exact Mass435.23
IUPAC NameN-[6-[4-[[2-ethoxy-5-(methoxymethyl)phenyl]methyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine
SMILESCCOc1ccc(COC)cc1CN1CCOC(c2cccc(Nc3cnccn3)n2)C1
InChIInChI=1S/C24H29N5O3/c1-3-31-21-8-7-18(17-30-2)13-19(21)15-29-11-12-32-22(16-29)20-5-4-6-23(27-20)28-24-14-25-9-10-26-24/h4-10,13-14,22H,3,11-12,15-17H2,1-2H3,(H,26,27,28)
InChIKeyVNXYSPJDYPQRGG-UHFFFAOYSA-N
XLogP3.73
TPSA81.63 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.53
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

N-[6-[4-[[2-methoxy-5-(methoxymethyl)phenyl]methyl]morpholin-2-yl]-2-pyridinyl]-5-methyl-1,3,4-thiadiazol-2-amine
CID 127249888
[5-[[(2R)-2-[6-[(1,5-dimethylpyrazol-3-yl)amino]-2-pyridinyl]morpholin-4-yl]methyl]-2-ethoxyphenyl]methanol
CID 124988259
2-[2-methoxy-4-[[(2S)-2-[6-(pyridin-2-ylamino)-2-pyridinyl]morpholin-4-yl]methyl]phenoxy]acetamide
CID 125013560
N-[6-[(2R)-1-[[3-(methoxymethyl)-4-propan-2-yloxyphenyl]methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine
CID 95835780
6-[(2R)-4-[(2-chlorophenyl)methyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-2-amine
CID 124980334
[5-[[(2S)-2-[5-[(4,6-dimethylpyrimidin-2-yl)amino]-2-pyridinyl]morpholin-4-yl]methyl]-2-ethoxyphenyl]methanol
CID 124990832
6-[1-[(3-methoxyphenyl)methyl]piperidin-4-yl]-N-pyrazin-2-ylpyrazin-2-amine
CID 110094104
6-[(3R)-1-[[2-ethoxy-5-(methoxymethyl)phenyl]methyl]piperidin-3-yl]-N,N-dimethyl-2-pyridin-3-ylpyrimidin-4-amine
CID 125018904
N-[6-[(2S)-4-[(2-methoxy-4-methylphenyl)methyl]morpholin-2-yl]-2-pyridinyl]-5-methyl-1,3,4-thiadiazol-2-amine
CID 124977478
6-[(2S)-4-[(2-methylpyrazol-3-yl)methyl]morpholin-2-yl]-N-pyridin-2-ylpyridin-2-amine
CID 124966544
6-[4-[(2,6-dimethoxyphenyl)methyl]morpholin-2-yl]-N-pyrimidin-2-ylpyrazin-2-amine
CID 127251771
6-[4-[(2-methoxy-4-methylphenyl)methyl]morpholin-2-yl]-N-pyrimidin-2-ylpyrazin-2-amine
CID 127251780

Frequently Asked Questions

What is the IUPAC name of N-[6-[4-[[2-ethoxy-5-(methoxymethyl)phenyl]methyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine?
The IUPAC name of N-[6-[4-[[2-ethoxy-5-(methoxymethyl)phenyl]methyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine (CID 110093053) is N-[6-[4-[[2-ethoxy-5-(methoxymethyl)phenyl]methyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine.
What is the SMILES notation for N-[6-[4-[[2-ethoxy-5-(methoxymethyl)phenyl]methyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine?
The canonical SMILES for N-[6-[4-[[2-ethoxy-5-(methoxymethyl)phenyl]methyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine is CCOc1ccc(COC)cc1CN1CCOC(c2cccc(Nc3cnccn3)n2)C1.
What is the InChIKey of N-[6-[4-[[2-ethoxy-5-(methoxymethyl)phenyl]methyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine?
The InChIKey is VNXYSPJDYPQRGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N5O3/c1-3-31-21-8-7-18(17-30-2)13-19(21)15-29-11-12-32-22(16-29)20-5-4-6-23(27-20)28-24-14-25-9-10-26-24/h4-10,13-14,22H,3,11-12,15-17H2,1-2H3,(H,26,27,28).
What are the key properties of N-[6-[4-[[2-ethoxy-5-(methoxymethyl)phenyl]methyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine?
N-[6-[4-[[2-ethoxy-5-(methoxymethyl)phenyl]methyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine has a molecular weight of 435.53 g/mol, XLogP of 3.73, 9 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[4-[[2-ethoxy-5-(methoxymethyl)phenyl]methyl]morpholin-2-yl]-2-pyridinyl]pyrazin-2-amine is sourced from PubChem (CID 110093053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).