N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-2-hydroxy-2-methylpropanamide

C18H19N5O2 — CID 135345133

IUPACN-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-2-hydroxy-2-methylpropanamide
SMILESCc1ccncc1-c1cc2cc(NC(=O)C(C)(C)O)ncc2c(N)n1
InChIInChI=1S/C18H19N5O2/c1-10-4-5-20-8-12(10)14-6-11-7-15(23-17(24)18(2,3)25)21-9-13(11)16(19)22-14/h4-9,25H,1-3H3,(H2,19,22)(H,21,23,24)
InChIKeyMQOHMSRBWNZZNS-UHFFFAOYSA-N
MW337.38 g/mol
LogP2.29
Rot. Bonds3

About N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-2-hydroxy-2-methylpropanamide

N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-2-hydroxy-2-methylpropanamide (PubChem CID 135345133) has the molecular formula C18H19N5O2 and a molecular weight of 337.38 g/mol. Its IUPAC name is N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-2-hydroxy-2-methylpropanamide.

Molecular Properties

Compound NameN-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-2-hydroxy-2-methylpropanamide
PubChem CID135345133
Molecular FormulaC18H19N5O2
Molecular Weight337.38 g/mol
Exact Mass337.15
IUPAC NameN-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-2-hydroxy-2-methylpropanamide
SMILESCc1ccncc1-c1cc2cc(NC(=O)C(C)(C)O)ncc2c(N)n1
InChIInChI=1S/C18H19N5O2/c1-10-4-5-20-8-12(10)14-6-11-7-15(23-17(24)18(2,3)25)21-9-13(11)16(19)22-14/h4-9,25H,1-3H3,(H2,19,22)(H,21,23,24)
InChIKeyMQOHMSRBWNZZNS-UHFFFAOYSA-N
XLogP2.29
TPSA114.02 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 52.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-2-hydroxy-2-methylpropanamide?
The IUPAC name of N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-2-hydroxy-2-methylpropanamide (CID 135345133) is N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-2-hydroxy-2-methylpropanamide.
What is the SMILES notation for N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-2-hydroxy-2-methylpropanamide?
The canonical SMILES for N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-2-hydroxy-2-methylpropanamide is Cc1ccncc1-c1cc2cc(NC(=O)C(C)(C)O)ncc2c(N)n1.
What is the InChIKey of N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-2-hydroxy-2-methylpropanamide?
The InChIKey is MQOHMSRBWNZZNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O2/c1-10-4-5-20-8-12(10)14-6-11-7-15(23-17(24)18(2,3)25)21-9-13(11)16(19)22-14/h4-9,25H,1-3H3,(H2,19,22)(H,21,23,24).
What are the key properties of N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-2-hydroxy-2-methylpropanamide?
N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-2-hydroxy-2-methylpropanamide has a molecular weight of 337.38 g/mol, XLogP of 2.29, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[8-amino-6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]-2-hydroxy-2-methylpropanamide is sourced from PubChem (CID 135345133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).