N-(4-methoxy-2-methylbutan-2-yl)-2-pyridin-4-yl-1,7-naphthyridin-4-amine

C19H22N4O — CID 135390653

IUPACN-(4-methoxy-2-methylbutan-2-yl)-2-pyridin-4-yl-1,7-naphthyridin-4-amine
SMILESCOCCC(C)(C)Nc1cc(-c2ccncc2)nc2cnccc12
InChIInChI=1S/C19H22N4O/c1-19(2,7-11-24-3)23-17-12-16(14-4-8-20-9-5-14)22-18-13-21-10-6-15(17)18/h4-6,8-10,12-13H,7,11H2,1-3H3,(H,22,23)
InChIKeyKUEGYYQIHIRUKP-UHFFFAOYSA-N
MW322.41 g/mol
LogP3.92
Rot. Bonds6

About N-(4-methoxy-2-methylbutan-2-yl)-2-pyridin-4-yl-1,7-naphthyridin-4-amine

N-(4-methoxy-2-methylbutan-2-yl)-2-pyridin-4-yl-1,7-naphthyridin-4-amine (PubChem CID 135390653) has the molecular formula C19H22N4O and a molecular weight of 322.41 g/mol. Its IUPAC name is N-(4-methoxy-2-methylbutan-2-yl)-2-pyridin-4-yl-1,7-naphthyridin-4-amine.

Molecular Properties

Compound NameN-(4-methoxy-2-methylbutan-2-yl)-2-pyridin-4-yl-1,7-naphthyridin-4-amine
PubChem CID135390653
Molecular FormulaC19H22N4O
Molecular Weight322.41 g/mol
Exact Mass322.18
IUPAC NameN-(4-methoxy-2-methylbutan-2-yl)-2-pyridin-4-yl-1,7-naphthyridin-4-amine
SMILESCOCCC(C)(C)Nc1cc(-c2ccncc2)nc2cnccc12
InChIInChI=1S/C19H22N4O/c1-19(2,7-11-24-3)23-17-12-16(14-4-8-20-9-5-14)22-18-13-21-10-6-15(17)18/h4-6,8-10,12-13H,7,11H2,1-3H3,(H,22,23)
InChIKeyKUEGYYQIHIRUKP-UHFFFAOYSA-N
XLogP3.92
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-2-methylbutan-2-yl)-2-pyridin-4-yl-1,7-naphthyridin-4-amine?
The IUPAC name of N-(4-methoxy-2-methylbutan-2-yl)-2-pyridin-4-yl-1,7-naphthyridin-4-amine (CID 135390653) is N-(4-methoxy-2-methylbutan-2-yl)-2-pyridin-4-yl-1,7-naphthyridin-4-amine.
What is the SMILES notation for N-(4-methoxy-2-methylbutan-2-yl)-2-pyridin-4-yl-1,7-naphthyridin-4-amine?
The canonical SMILES for N-(4-methoxy-2-methylbutan-2-yl)-2-pyridin-4-yl-1,7-naphthyridin-4-amine is COCCC(C)(C)Nc1cc(-c2ccncc2)nc2cnccc12.
What is the InChIKey of N-(4-methoxy-2-methylbutan-2-yl)-2-pyridin-4-yl-1,7-naphthyridin-4-amine?
The InChIKey is KUEGYYQIHIRUKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O/c1-19(2,7-11-24-3)23-17-12-16(14-4-8-20-9-5-14)22-18-13-21-10-6-15(17)18/h4-6,8-10,12-13H,7,11H2,1-3H3,(H,22,23).
What are the key properties of N-(4-methoxy-2-methylbutan-2-yl)-2-pyridin-4-yl-1,7-naphthyridin-4-amine?
N-(4-methoxy-2-methylbutan-2-yl)-2-pyridin-4-yl-1,7-naphthyridin-4-amine has a molecular weight of 322.41 g/mol, XLogP of 3.92, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-2-methylbutan-2-yl)-2-pyridin-4-yl-1,7-naphthyridin-4-amine is sourced from PubChem (CID 135390653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).