N-[5-(methoxymethyl)-4-[[6-methoxy-5-(1-methylpyrazol-3-yl)-2-pyridinyl]amino]-2-pyridinyl]acetamide

C19H22N6O3 — CID 170731141

IUPACN-[5-(methoxymethyl)-4-[[6-methoxy-5-(1-methylpyrazol-3-yl)-2-pyridinyl]amino]-2-pyridinyl]acetamide
SMILESCOCc1cnc(NC(C)=O)cc1Nc1ccc(-c2ccn(C)n2)c(OC)n1
InChIInChI=1S/C19H22N6O3/c1-12(26)21-18-9-16(13(10-20-18)11-27-3)22-17-6-5-14(19(23-17)28-4)15-7-8-25(2)24-15/h5-10H,11H2,1-4H3,(H2,20,21,22,23,26)
InChIKeyGDIGOMIDSOQQHQ-UHFFFAOYSA-N
MW382.42 g/mol
LogP2.73
Rot. Bonds7

About N-[5-(methoxymethyl)-4-[[6-methoxy-5-(1-methylpyrazol-3-yl)-2-pyridinyl]amino]-2-pyridinyl]acetamide

N-[5-(methoxymethyl)-4-[[6-methoxy-5-(1-methylpyrazol-3-yl)-2-pyridinyl]amino]-2-pyridinyl]acetamide (PubChem CID 170731141) has the molecular formula C19H22N6O3 and a molecular weight of 382.42 g/mol. Its IUPAC name is N-[5-(methoxymethyl)-4-[[6-methoxy-5-(1-methylpyrazol-3-yl)-2-pyridinyl]amino]-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[5-(methoxymethyl)-4-[[6-methoxy-5-(1-methylpyrazol-3-yl)-2-pyridinyl]amino]-2-pyridinyl]acetamide
PubChem CID170731141
Molecular FormulaC19H22N6O3
Molecular Weight382.42 g/mol
Exact Mass382.18
IUPAC NameN-[5-(methoxymethyl)-4-[[6-methoxy-5-(1-methylpyrazol-3-yl)-2-pyridinyl]amino]-2-pyridinyl]acetamide
SMILESCOCc1cnc(NC(C)=O)cc1Nc1ccc(-c2ccn(C)n2)c(OC)n1
InChIInChI=1S/C19H22N6O3/c1-12(26)21-18-9-16(13(10-20-18)11-27-3)22-17-6-5-14(19(23-17)28-4)15-7-8-25(2)24-15/h5-10H,11H2,1-4H3,(H2,20,21,22,23,26)
InChIKeyGDIGOMIDSOQQHQ-UHFFFAOYSA-N
XLogP2.73
TPSA103.19 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.42
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

N-[4-[[4-(methoxymethyl)-6-methylsulfonyl-2-pyridinyl]amino]-5-(1-methylpyrazol-3-yl)-2-pyridinyl]acetamide
CID 166918499
N-[4-[[2-(1,1-difluoroethyl)-6-(2-methoxyethoxy)pyrimidin-4-yl]amino]-5-(1-methylpyrazol-3-yl)-2-pyridinyl]acetamide
CID 170730760
N-[4-[(3-methoxy-6-methylsulfonyl-2-pyridinyl)amino]-5-(1-methylpyrazol-3-yl)-2-pyridinyl]acetamide
CID 166918696
N-[4-[(4-ethoxy-6-methylsulfonyl-2-pyridinyl)amino]-5-(1-methylpyrazol-3-yl)-2-pyridinyl]acetamide
CID 166918982
N-[4-[[4-(2-methoxypropoxy)-6-methylsulfonyl-2-pyridinyl]amino]-5-(1-methylpyrazol-3-yl)-2-pyridinyl]acetamide
CID 166918359
N-[4-[[4-(cyclopropylmethoxy)-6-methylsulfonyl-2-pyridinyl]amino]-5-(1-methylpyrazol-3-yl)-2-pyridinyl]acetamide
CID 166918615
N-[4-[[6-cyclopropyl-2-(1,1-difluoroethyl)pyrimidin-4-yl]amino]-5-(1-methylpyrazol-3-yl)-2-pyridinyl]acetamide
CID 175991041
N-[4-[3-(2-hydroxyethoxy)-5-methylsulfonylanilino]-5-(1-methylpyrazol-3-yl)-2-pyridinyl]acetamide
CID 166918661
N-[4-(3-fluoro-5-methylsulfonylanilino)-5-(1-methylpyrazol-3-yl)-2-pyridinyl]acetamide
CID 166918388
N-[4-[[6-methyl-2-(oxolan-3-yl)pyrimidin-4-yl]amino]-5-(1-methylpyrazol-3-yl)-2-pyridinyl]acetamide
CID 170730825
N-[4-(3-cyano-5-methylsulfonylanilino)-5-(1-methylpyrazol-3-yl)-2-pyridinyl]acetamide
CID 166918333
N-[5-[1-(2-hydroxyethyl)pyrazol-3-yl]-4-[(6-methylsulfonyl-4-propan-2-yloxy-2-pyridinyl)amino]-2-pyridinyl]acetamide
CID 167439722

Frequently Asked Questions

What is the IUPAC name of N-[5-(methoxymethyl)-4-[[6-methoxy-5-(1-methylpyrazol-3-yl)-2-pyridinyl]amino]-2-pyridinyl]acetamide?
The IUPAC name of N-[5-(methoxymethyl)-4-[[6-methoxy-5-(1-methylpyrazol-3-yl)-2-pyridinyl]amino]-2-pyridinyl]acetamide (CID 170731141) is N-[5-(methoxymethyl)-4-[[6-methoxy-5-(1-methylpyrazol-3-yl)-2-pyridinyl]amino]-2-pyridinyl]acetamide.
What is the SMILES notation for N-[5-(methoxymethyl)-4-[[6-methoxy-5-(1-methylpyrazol-3-yl)-2-pyridinyl]amino]-2-pyridinyl]acetamide?
The canonical SMILES for N-[5-(methoxymethyl)-4-[[6-methoxy-5-(1-methylpyrazol-3-yl)-2-pyridinyl]amino]-2-pyridinyl]acetamide is COCc1cnc(NC(C)=O)cc1Nc1ccc(-c2ccn(C)n2)c(OC)n1.
What is the InChIKey of N-[5-(methoxymethyl)-4-[[6-methoxy-5-(1-methylpyrazol-3-yl)-2-pyridinyl]amino]-2-pyridinyl]acetamide?
The InChIKey is GDIGOMIDSOQQHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O3/c1-12(26)21-18-9-16(13(10-20-18)11-27-3)22-17-6-5-14(19(23-17)28-4)15-7-8-25(2)24-15/h5-10H,11H2,1-4H3,(H2,20,21,22,23,26).
What are the key properties of N-[5-(methoxymethyl)-4-[[6-methoxy-5-(1-methylpyrazol-3-yl)-2-pyridinyl]amino]-2-pyridinyl]acetamide?
N-[5-(methoxymethyl)-4-[[6-methoxy-5-(1-methylpyrazol-3-yl)-2-pyridinyl]amino]-2-pyridinyl]acetamide has a molecular weight of 382.42 g/mol, XLogP of 2.73, 7 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(methoxymethyl)-4-[[6-methoxy-5-(1-methylpyrazol-3-yl)-2-pyridinyl]amino]-2-pyridinyl]acetamide is sourced from PubChem (CID 170731141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).