N-cyclohexyl-7-methyl-2-phenyl-1,8-naphthyridin-4-amine

C21H23N3 — CID 10757861

IUPACN-cyclohexyl-7-methyl-2-phenyl-1,8-naphthyridin-4-amine
SMILESCc1ccc2c(NC3CCCCC3)cc(-c3ccccc3)nc2n1
InChIInChI=1S/C21H23N3/c1-15-12-13-18-20(23-17-10-6-3-7-11-17)14-19(24-21(18)22-15)16-8-4-2-5-9-16/h2,4-5,8-9,12-14,17H,3,6-7,10-11H2,1H3,(H,22,23,24)
InChIKeyNCXRGWNKMATFFY-UHFFFAOYSA-N
MW317.44 g/mol
LogP5.35
Rot. Bonds3

About N-cyclohexyl-7-methyl-2-phenyl-1,8-naphthyridin-4-amine

N-cyclohexyl-7-methyl-2-phenyl-1,8-naphthyridin-4-amine (PubChem CID 10757861) has the molecular formula C21H23N3 and a molecular weight of 317.44 g/mol. Its IUPAC name is N-cyclohexyl-7-methyl-2-phenyl-1,8-naphthyridin-4-amine.

Molecular Properties

Compound NameN-cyclohexyl-7-methyl-2-phenyl-1,8-naphthyridin-4-amine
PubChem CID10757861
Molecular FormulaC21H23N3
Molecular Weight317.44 g/mol
Exact Mass317.19
IUPAC NameN-cyclohexyl-7-methyl-2-phenyl-1,8-naphthyridin-4-amine
SMILESCc1ccc2c(NC3CCCCC3)cc(-c3ccccc3)nc2n1
InChIInChI=1S/C21H23N3/c1-15-12-13-18-20(23-17-10-6-3-7-11-17)14-19(24-21(18)22-15)16-8-4-2-5-9-16/h2,4-5,8-9,12-14,17H,3,6-7,10-11H2,1H3,(H,22,23,24)
InChIKeyNCXRGWNKMATFFY-UHFFFAOYSA-N
XLogP5.35
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500317.44
LogP ≤ 55.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-7-methyl-2-phenyl-1,8-naphthyridin-4-amine?
The IUPAC name of N-cyclohexyl-7-methyl-2-phenyl-1,8-naphthyridin-4-amine (CID 10757861) is N-cyclohexyl-7-methyl-2-phenyl-1,8-naphthyridin-4-amine.
What is the SMILES notation for N-cyclohexyl-7-methyl-2-phenyl-1,8-naphthyridin-4-amine?
The canonical SMILES for N-cyclohexyl-7-methyl-2-phenyl-1,8-naphthyridin-4-amine is Cc1ccc2c(NC3CCCCC3)cc(-c3ccccc3)nc2n1.
What is the InChIKey of N-cyclohexyl-7-methyl-2-phenyl-1,8-naphthyridin-4-amine?
The InChIKey is NCXRGWNKMATFFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3/c1-15-12-13-18-20(23-17-10-6-3-7-11-17)14-19(24-21(18)22-15)16-8-4-2-5-9-16/h2,4-5,8-9,12-14,17H,3,6-7,10-11H2,1H3,(H,22,23,24).
What are the key properties of N-cyclohexyl-7-methyl-2-phenyl-1,8-naphthyridin-4-amine?
N-cyclohexyl-7-methyl-2-phenyl-1,8-naphthyridin-4-amine has a molecular weight of 317.44 g/mol, XLogP of 5.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-7-methyl-2-phenyl-1,8-naphthyridin-4-amine is sourced from PubChem (CID 10757861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).