1-N,1-N,5-N,5-N-tetrapyridin-2-ylnaphthalene-1,5-diamine

C30H22N6 — CID 102277390

IUPAC1-N,1-N,5-N,5-N-tetrapyridin-2-ylnaphthalene-1,5-diamine
SMILESc1ccc(N(c2ccccn2)c2cccc3c(N(c4ccccn4)c4ccccn4)cccc23)nc1
InChIInChI=1S/C30H22N6/c1-5-19-31-27(15-1)35(28-16-2-6-20-32-28)25-13-9-12-24-23(25)11-10-14-26(24)36(29-17-3-7-21-33-29)30-18-4-8-22-34-30/h1-22H
InChIKeyQRUUCXQATQDPJR-UHFFFAOYSA-N
MW466.55 g/mol
LogP7.36
Rot. Bonds6

About 1-N,1-N,5-N,5-N-tetrapyridin-2-ylnaphthalene-1,5-diamine

1-N,1-N,5-N,5-N-tetrapyridin-2-ylnaphthalene-1,5-diamine (PubChem CID 102277390) has the molecular formula C30H22N6 and a molecular weight of 466.55 g/mol. Its IUPAC name is 1-N,1-N,5-N,5-N-tetrapyridin-2-ylnaphthalene-1,5-diamine.

Molecular Properties

Compound Name1-N,1-N,5-N,5-N-tetrapyridin-2-ylnaphthalene-1,5-diamine
PubChem CID102277390
Molecular FormulaC30H22N6
Molecular Weight466.55 g/mol
Exact Mass466.19
IUPAC Name1-N,1-N,5-N,5-N-tetrapyridin-2-ylnaphthalene-1,5-diamine
SMILESc1ccc(N(c2ccccn2)c2cccc3c(N(c4ccccn4)c4ccccn4)cccc23)nc1
InChIInChI=1S/C30H22N6/c1-5-19-31-27(15-1)35(28-16-2-6-20-32-28)25-13-9-12-24-23(25)11-10-14-26(24)36(29-17-3-7-21-33-29)30-18-4-8-22-34-30/h1-22H
InChIKeyQRUUCXQATQDPJR-UHFFFAOYSA-N
XLogP7.36
TPSA58.04 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500466.55
LogP ≤ 57.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

Cyclohexyl-(4-(1-piperazin-1-yl(2,6)naphthyridin-3-yl)pyridin-2-yl)amine
CID 25020250
5-Methyl-6-[(1-naphthylamino)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine
CID 456205
5-Methyl-6-[(tetralin-5-ylamino)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine
CID 457353
6-(Isoquinolin-5-ylaminomethyl)-5-methyl-pyrido[2,3-d]pyrimidine-2,4-diamine
CID 470317
N-(4-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)butyl)isoquinolin-1-amine
CID 11554490
1-[3-(2-Cyclohexylaminopyridin-4-yl)[2,6]naphthyridin-1-yl]-piperidine-4-carboxylic Acid Piperidin-4-ylamide
CID 46900230
N'-(3-pyridin-2-ylisoquinolin-1-yl)pyridine-2-carboximidamide
CID 463108
N~6~-methyl-N~6~-(naphthalen-1-yl)pyrido[2,3-d]pyrimidine-2,4,6-triamine
CID 71681191
N-naphthalen-1-yl-2-pyridin-4-ylquinazolin-4-amine
CID 921313
6-Piperidin-1-yl-phenanthridine
CID 2853903
N-[(E)-naphthalen-1-ylmethylidene]-4-(pyridin-2-yl)piperazin-1-amine
CID 5342978
2-[4-(2-Pyrimidinyl)-1-piperazinyl]quinoline
CID 7033665

Frequently Asked Questions

What is the IUPAC name of 1-N,1-N,5-N,5-N-tetrapyridin-2-ylnaphthalene-1,5-diamine?
The IUPAC name of 1-N,1-N,5-N,5-N-tetrapyridin-2-ylnaphthalene-1,5-diamine (CID 102277390) is 1-N,1-N,5-N,5-N-tetrapyridin-2-ylnaphthalene-1,5-diamine.
What is the SMILES notation for 1-N,1-N,5-N,5-N-tetrapyridin-2-ylnaphthalene-1,5-diamine?
The canonical SMILES for 1-N,1-N,5-N,5-N-tetrapyridin-2-ylnaphthalene-1,5-diamine is c1ccc(N(c2ccccn2)c2cccc3c(N(c4ccccn4)c4ccccn4)cccc23)nc1.
What is the InChIKey of 1-N,1-N,5-N,5-N-tetrapyridin-2-ylnaphthalene-1,5-diamine?
The InChIKey is QRUUCXQATQDPJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H22N6/c1-5-19-31-27(15-1)35(28-16-2-6-20-32-28)25-13-9-12-24-23(25)11-10-14-26(24)36(29-17-3-7-21-33-29)30-18-4-8-22-34-30/h1-22H.
What are the key properties of 1-N,1-N,5-N,5-N-tetrapyridin-2-ylnaphthalene-1,5-diamine?
1-N,1-N,5-N,5-N-tetrapyridin-2-ylnaphthalene-1,5-diamine has a molecular weight of 466.55 g/mol, XLogP of 7.36, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N,5-N,5-N-tetrapyridin-2-ylnaphthalene-1,5-diamine is sourced from PubChem (CID 102277390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).