1-(4-methylpiperazin-1-yl)-3-pyridin-4-yl-2,6-naphthyridine

C18H19N5 — CID 68599583

IUPAC1-(4-methylpiperazin-1-yl)-3-pyridin-4-yl-2,6-naphthyridine
SMILESCN1CCN(c2nc(-c3ccncc3)cc3cnccc23)CC1
InChIInChI=1S/C18H19N5/c1-22-8-10-23(11-9-22)18-16-4-7-20-13-15(16)12-17(21-18)14-2-5-19-6-3-14/h2-7,12-13H,8-11H2,1H3
InChIKeyVENDCZIAUMNFOR-UHFFFAOYSA-N
MW305.38 g/mol
LogP2.44
Rot. Bonds2

About 1-(4-methylpiperazin-1-yl)-3-pyridin-4-yl-2,6-naphthyridine

1-(4-methylpiperazin-1-yl)-3-pyridin-4-yl-2,6-naphthyridine (PubChem CID 68599583) has the molecular formula C18H19N5 and a molecular weight of 305.38 g/mol. Its IUPAC name is 1-(4-methylpiperazin-1-yl)-3-pyridin-4-yl-2,6-naphthyridine.

Molecular Properties

Compound Name1-(4-methylpiperazin-1-yl)-3-pyridin-4-yl-2,6-naphthyridine
PubChem CID68599583
Molecular FormulaC18H19N5
Molecular Weight305.38 g/mol
Exact Mass305.16
IUPAC Name1-(4-methylpiperazin-1-yl)-3-pyridin-4-yl-2,6-naphthyridine
SMILESCN1CCN(c2nc(-c3ccncc3)cc3cnccc23)CC1
InChIInChI=1S/C18H19N5/c1-22-8-10-23(11-9-22)18-16-4-7-20-13-15(16)12-17(21-18)14-2-5-19-6-3-14/h2-7,12-13H,8-11H2,1H3
InChIKeyVENDCZIAUMNFOR-UHFFFAOYSA-N
XLogP2.44
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(3S)-3-methylpiperazin-1-yl]-3-pyridin-4-yl-2,6-naphthyridine
CID 68596700
1-(4-ethylpiperazin-1-yl)-3-(4-methoxyphenyl)-2,6-naphthyridine
CID 22502740
[1-(3-pyridin-4-yl-2,6-naphthyridin-1-yl)piperidin-3-yl]methanamine
CID 68596973
4-(1-piperazin-1-yl-2,6-naphthyridin-3-yl)-N-propan-2-ylpyridin-2-amine
CID 67026531
3-(4-methyl-1,4-diazepan-1-yl)-5-pyridin-4-ylpyrazin-2-amine
CID 11694866
N-cyclopentyl-4-(1-piperazin-1-yl-2,6-naphthyridin-3-yl)pyridin-2-amine
CID 67026736
1-[3-(2-chloro-4-pyridinyl)-2,6-naphthyridin-1-yl]piperidine-4-carboxamide
CID 46899714
1-[3-[2-(butan-2-ylamino)-4-pyridinyl]-2,6-naphthyridin-1-yl]piperidine-4-carboxylic acid
CID 123151361
tert-butyl 4-[3-[2-(oxan-4-ylamino)-4-pyridinyl]-2,6-naphthyridin-1-yl]piperazine-1-carboxylate
CID 46899900
4-[1-(3-aminopyrrolidin-1-yl)-2,6-naphthyridin-3-yl]-N-cyclohexylpyridin-2-amine
CID 25020309
N-[2-[4-[3-[2-(oxan-4-ylamino)-4-pyridinyl]-2,6-naphthyridin-1-yl]piperazin-1-yl]-2-oxoethyl]acetamide
CID 67026560
1-[5-(4-iodophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-4-methylpiperazine
CID 15485911

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylpiperazin-1-yl)-3-pyridin-4-yl-2,6-naphthyridine?
The IUPAC name of 1-(4-methylpiperazin-1-yl)-3-pyridin-4-yl-2,6-naphthyridine (CID 68599583) is 1-(4-methylpiperazin-1-yl)-3-pyridin-4-yl-2,6-naphthyridine.
What is the SMILES notation for 1-(4-methylpiperazin-1-yl)-3-pyridin-4-yl-2,6-naphthyridine?
The canonical SMILES for 1-(4-methylpiperazin-1-yl)-3-pyridin-4-yl-2,6-naphthyridine is CN1CCN(c2nc(-c3ccncc3)cc3cnccc23)CC1.
What is the InChIKey of 1-(4-methylpiperazin-1-yl)-3-pyridin-4-yl-2,6-naphthyridine?
The InChIKey is VENDCZIAUMNFOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5/c1-22-8-10-23(11-9-22)18-16-4-7-20-13-15(16)12-17(21-18)14-2-5-19-6-3-14/h2-7,12-13H,8-11H2,1H3.
What are the key properties of 1-(4-methylpiperazin-1-yl)-3-pyridin-4-yl-2,6-naphthyridine?
1-(4-methylpiperazin-1-yl)-3-pyridin-4-yl-2,6-naphthyridine has a molecular weight of 305.38 g/mol, XLogP of 2.44, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylpiperazin-1-yl)-3-pyridin-4-yl-2,6-naphthyridine is sourced from PubChem (CID 68599583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).