6-[6-(ethylamino)-3-pyridinyl]-N-[2-(1,5-naphthyridin-4-yl)ethyl]pyrimidin-4-amine

C21H21N7 — CID 123280961

IUPAC6-[6-(ethylamino)-3-pyridinyl]-N-[2-(1,5-naphthyridin-4-yl)ethyl]pyrimidin-4-amine
SMILESCCNc1ccc(-c2cc(NCCc3ccnc4cccnc34)ncn2)cn1
InChIInChI=1S/C21H21N7/c1-2-22-19-6-5-16(13-26-19)18-12-20(28-14-27-18)24-11-8-15-7-10-23-17-4-3-9-25-21(15)17/h3-7,9-10,12-14H,2,8,11H2,1H3,(H,22,26)(H,24,27,28)
InChIKeyHFFYYRFYMOHMHO-UHFFFAOYSA-N
MW371.45 g/mol
LogP3.57
Rot. Bonds7

About 6-[6-(ethylamino)-3-pyridinyl]-N-[2-(1,5-naphthyridin-4-yl)ethyl]pyrimidin-4-amine

6-[6-(ethylamino)-3-pyridinyl]-N-[2-(1,5-naphthyridin-4-yl)ethyl]pyrimidin-4-amine (PubChem CID 123280961) has the molecular formula C21H21N7 and a molecular weight of 371.45 g/mol. Its IUPAC name is 6-[6-(ethylamino)-3-pyridinyl]-N-[2-(1,5-naphthyridin-4-yl)ethyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-[6-(ethylamino)-3-pyridinyl]-N-[2-(1,5-naphthyridin-4-yl)ethyl]pyrimidin-4-amine
PubChem CID123280961
Molecular FormulaC21H21N7
Molecular Weight371.45 g/mol
Exact Mass371.19
IUPAC Name6-[6-(ethylamino)-3-pyridinyl]-N-[2-(1,5-naphthyridin-4-yl)ethyl]pyrimidin-4-amine
SMILESCCNc1ccc(-c2cc(NCCc3ccnc4cccnc34)ncn2)cn1
InChIInChI=1S/C21H21N7/c1-2-22-19-6-5-16(13-26-19)18-12-20(28-14-27-18)24-11-8-15-7-10-23-17-4-3-9-25-21(15)17/h3-7,9-10,12-14H,2,8,11H2,1H3,(H,22,26)(H,24,27,28)
InChIKeyHFFYYRFYMOHMHO-UHFFFAOYSA-N
XLogP3.57
TPSA88.51 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.45
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 6-[6-(ethylamino)-3-pyridinyl]-N-[2-(1,5-naphthyridin-4-yl)ethyl]pyrimidin-4-amine with MolForge

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Related Compounds

N-ethyl-6-quinolin-5-ylpyrimidin-4-amine
CID 81221755
8-[2-[[6-(6-methoxy-3-pyridinyl)pyrimidin-4-yl]amino]ethyl]-N-methylquinoline-4-carboxamide
CID 134288939
6-[6-(ethylamino)-3-pyridinyl]-N-[2-(2-methylfuro[3,2-b]pyridin-7-yl)-2-methylsulfanylethyl]pyrimidin-4-amine
CID 123904725
N-methyl-8-[2-[[6-[2-(2,2,2-trifluoroethoxy)pyrimidin-5-yl]pyrimidin-4-yl]amino]ethyl]quinoline-4-carboxamide
CID 134289217
N-[(2S)-2-(2,3-dihydrofuro[3,2-b]pyridin-7-yl)propyl]-6-[6-(ethylamino)-3-pyridinyl]pyrimidin-4-amine;sulfane
CID 162215068
N-[2-(3,4-dihydro-2H-pyrano[3,2-b]pyridin-8-yl)ethyl]-6-(6-methyl-3-pyridinyl)pyrimidin-4-amine
CID 130428708
8-[2-[[6-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-7-yl)pyrimidin-4-yl]amino]ethyl]-5-fluoro-N-methylquinoline-4-carboxamide
CID 134289254
8-[2-[[6-[6-(cyclopropylmethoxy)-3-pyridinyl]pyrimidin-4-yl]amino]ethyl]-N-methylquinoline-4-carboxamide
CID 134289270
8-[2-[[6-(2,6-dimethyl-4-pyridinyl)pyrimidin-4-yl]amino]ethyl]-N-methylquinoline-4-carboxamide
CID 130428727
8-[2-[[6-[2-[[2-(dimethylamino)-2-oxoethyl]amino]pyrimidin-5-yl]pyrimidin-4-yl]amino]ethyl]-N-methylquinoline-4-carboxamide
CID 134289262
[8-[1-[[6-(6-methyl-3-pyridinyl)pyrimidin-4-yl]amino]propan-2-yl]quinolin-4-yl]methanol
CID 135217314
8-[2-[[6-[4-(cyclopropylcarbamoyl)phenyl]pyrimidin-4-yl]amino]ethyl]-N-methylquinoline-4-carboxamide
CID 134289260

Frequently Asked Questions

What is the IUPAC name of 6-[6-(ethylamino)-3-pyridinyl]-N-[2-(1,5-naphthyridin-4-yl)ethyl]pyrimidin-4-amine?
The IUPAC name of 6-[6-(ethylamino)-3-pyridinyl]-N-[2-(1,5-naphthyridin-4-yl)ethyl]pyrimidin-4-amine (CID 123280961) is 6-[6-(ethylamino)-3-pyridinyl]-N-[2-(1,5-naphthyridin-4-yl)ethyl]pyrimidin-4-amine.
What is the SMILES notation for 6-[6-(ethylamino)-3-pyridinyl]-N-[2-(1,5-naphthyridin-4-yl)ethyl]pyrimidin-4-amine?
The canonical SMILES for 6-[6-(ethylamino)-3-pyridinyl]-N-[2-(1,5-naphthyridin-4-yl)ethyl]pyrimidin-4-amine is CCNc1ccc(-c2cc(NCCc3ccnc4cccnc34)ncn2)cn1.
What is the InChIKey of 6-[6-(ethylamino)-3-pyridinyl]-N-[2-(1,5-naphthyridin-4-yl)ethyl]pyrimidin-4-amine?
The InChIKey is HFFYYRFYMOHMHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N7/c1-2-22-19-6-5-16(13-26-19)18-12-20(28-14-27-18)24-11-8-15-7-10-23-17-4-3-9-25-21(15)17/h3-7,9-10,12-14H,2,8,11H2,1H3,(H,22,26)(H,24,27,28).
What are the key properties of 6-[6-(ethylamino)-3-pyridinyl]-N-[2-(1,5-naphthyridin-4-yl)ethyl]pyrimidin-4-amine?
6-[6-(ethylamino)-3-pyridinyl]-N-[2-(1,5-naphthyridin-4-yl)ethyl]pyrimidin-4-amine has a molecular weight of 371.45 g/mol, XLogP of 3.57, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-(ethylamino)-3-pyridinyl]-N-[2-(1,5-naphthyridin-4-yl)ethyl]pyrimidin-4-amine is sourced from PubChem (CID 123280961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).