4-chloro-2-methyl-8-(2,4,6-trimethylphenyl)-1,7-naphthyridine

C18H17ClN2 — CID 22711989

IUPAC4-chloro-2-methyl-8-(2,4,6-trimethylphenyl)-1,7-naphthyridine
SMILESCc1cc(C)c(-c2nccc3c(Cl)cc(C)nc23)c(C)c1
InChIInChI=1S/C18H17ClN2/c1-10-7-11(2)16(12(3)8-10)18-17-14(5-6-20-18)15(19)9-13(4)21-17/h5-9H,1-4H3
InChIKeyUKGFJKSPXHXDHD-UHFFFAOYSA-N
MW296.80 g/mol
LogP5.18
Rot. Bonds1

About 4-chloro-2-methyl-8-(2,4,6-trimethylphenyl)-1,7-naphthyridine

4-chloro-2-methyl-8-(2,4,6-trimethylphenyl)-1,7-naphthyridine (PubChem CID 22711989) has the molecular formula C18H17ClN2 and a molecular weight of 296.80 g/mol. Its IUPAC name is 4-chloro-2-methyl-8-(2,4,6-trimethylphenyl)-1,7-naphthyridine.

Molecular Properties

Compound Name4-chloro-2-methyl-8-(2,4,6-trimethylphenyl)-1,7-naphthyridine
PubChem CID22711989
Molecular FormulaC18H17ClN2
Molecular Weight296.80 g/mol
Exact Mass296.11
IUPAC Name4-chloro-2-methyl-8-(2,4,6-trimethylphenyl)-1,7-naphthyridine
SMILESCc1cc(C)c(-c2nccc3c(Cl)cc(C)nc23)c(C)c1
InChIInChI=1S/C18H17ClN2/c1-10-7-11(2)16(12(3)8-10)18-17-14(5-6-20-18)15(19)9-13(4)21-17/h5-9H,1-4H3
InChIKeyUKGFJKSPXHXDHD-UHFFFAOYSA-N
XLogP5.18
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500296.80
LogP ≤ 55.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

CID 72791
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CID 72792
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CID 74265
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CID 77865
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CID 93149
CID 93149
CID 76357
CID 76357
CID 355193
CID 355193
CID 4913356
CID 4913356
CID 11401613
CID 11401613
CID 73350
CID 73350
CID 15783796
CID 15783796
CID 7275193
CID 7275193

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-methyl-8-(2,4,6-trimethylphenyl)-1,7-naphthyridine?
The IUPAC name of 4-chloro-2-methyl-8-(2,4,6-trimethylphenyl)-1,7-naphthyridine (CID 22711989) is 4-chloro-2-methyl-8-(2,4,6-trimethylphenyl)-1,7-naphthyridine.
What is the SMILES notation for 4-chloro-2-methyl-8-(2,4,6-trimethylphenyl)-1,7-naphthyridine?
The canonical SMILES for 4-chloro-2-methyl-8-(2,4,6-trimethylphenyl)-1,7-naphthyridine is Cc1cc(C)c(-c2nccc3c(Cl)cc(C)nc23)c(C)c1.
What is the InChIKey of 4-chloro-2-methyl-8-(2,4,6-trimethylphenyl)-1,7-naphthyridine?
The InChIKey is UKGFJKSPXHXDHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN2/c1-10-7-11(2)16(12(3)8-10)18-17-14(5-6-20-18)15(19)9-13(4)21-17/h5-9H,1-4H3.
What are the key properties of 4-chloro-2-methyl-8-(2,4,6-trimethylphenyl)-1,7-naphthyridine?
4-chloro-2-methyl-8-(2,4,6-trimethylphenyl)-1,7-naphthyridine has a molecular weight of 296.80 g/mol, XLogP of 5.18, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-methyl-8-(2,4,6-trimethylphenyl)-1,7-naphthyridine is sourced from PubChem (CID 22711989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).