6-[(4-methyl-2-pyridinyl)amino]-8-(piperidin-4-ylmethylamino)-2H-2,7-naphthyridin-1-one

C20H24N6O — CID 66925452

IUPAC6-[(4-methyl-2-pyridinyl)amino]-8-(piperidin-4-ylmethylamino)-2H-2,7-naphthyridin-1-one
SMILESCc1ccnc(Nc2cc3cc[nH]c(=O)c3c(NCC3CCNCC3)n2)c1
InChIInChI=1S/C20H24N6O/c1-13-2-8-22-16(10-13)25-17-11-15-5-9-23-20(27)18(15)19(26-17)24-12-14-3-6-21-7-4-14/h2,5,8-11,14,21H,3-4,6-7,12H2,1H3,(H,23,27)(H2,22,24,25,26)
InChIKeyLKTBIYGQHSZMQN-UHFFFAOYSA-N
MW364.45 g/mol
LogP2.78
Rot. Bonds5

About 6-[(4-methyl-2-pyridinyl)amino]-8-(piperidin-4-ylmethylamino)-2H-2,7-naphthyridin-1-one

6-[(4-methyl-2-pyridinyl)amino]-8-(piperidin-4-ylmethylamino)-2H-2,7-naphthyridin-1-one (PubChem CID 66925452) has the molecular formula C20H24N6O and a molecular weight of 364.45 g/mol. Its IUPAC name is 6-[(4-methyl-2-pyridinyl)amino]-8-(piperidin-4-ylmethylamino)-2H-2,7-naphthyridin-1-one.

Molecular Properties

Compound Name6-[(4-methyl-2-pyridinyl)amino]-8-(piperidin-4-ylmethylamino)-2H-2,7-naphthyridin-1-one
PubChem CID66925452
Molecular FormulaC20H24N6O
Molecular Weight364.45 g/mol
Exact Mass364.20
IUPAC Name6-[(4-methyl-2-pyridinyl)amino]-8-(piperidin-4-ylmethylamino)-2H-2,7-naphthyridin-1-one
SMILESCc1ccnc(Nc2cc3cc[nH]c(=O)c3c(NCC3CCNCC3)n2)c1
InChIInChI=1S/C20H24N6O/c1-13-2-8-22-16(10-13)25-17-11-15-5-9-23-20(27)18(15)19(26-17)24-12-14-3-6-21-7-4-14/h2,5,8-11,14,21H,3-4,6-7,12H2,1H3,(H,23,27)(H2,22,24,25,26)
InChIKeyLKTBIYGQHSZMQN-UHFFFAOYSA-N
XLogP2.78
TPSA94.73 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 52.78
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Analyze 6-[(4-methyl-2-pyridinyl)amino]-8-(piperidin-4-ylmethylamino)-2H-2,7-naphthyridin-1-one with MolForge

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Related Compounds

8-(cyclohexylmethylamino)-6-[(4-methyl-2-pyridinyl)amino]-2H-2,7-naphthyridin-1-one
CID 58166852
6-[(4-chloro-2-pyridinyl)amino]-8-(propan-2-ylamino)-2H-2,7-naphthyridin-1-one
CID 58166928
2-[[1-(cyclopropylamino)-8-oxo-7H-2,7-naphthyridin-3-yl]amino]pyridine-4-carboxamide
CID 58167290
2-methyl-6-[(4-methyl-2-pyridinyl)amino]-8-[[(2R)-oxolan-2-yl]methylamino]-2,7-naphthyridin-1-one
CID 50925172
6-(2-aminopyrimidin-5-yl)-8-(cyclopropylmethylamino)-2H-2,7-naphthyridin-1-one
CID 58167367
8-[4-[2-(4-ethylpiperazin-1-yl)ethyl]anilino]-6-[(4-ethyl-2-pyridinyl)amino]-2H-2,7-naphthyridin-1-one
CID 58166701
8-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-methyl-6-[(4-methyl-2-pyridinyl)amino]-2,7-naphthyridin-1-one
CID 50925036
N-(piperidin-4-ylmethyl)-4-propan-2-ylpyridin-2-amine
CID 126724513
8-(tert-butylamino)-2-ethyl-6-[(4-methyl-2-pyridinyl)amino]-2,7-naphthyridin-1-one
CID 58167093
2-(azetidin-1-yl)-N-(4-methyl-2-pyridinyl)-6-piperidin-4-ylpyrimidin-4-amine
CID 86342169
5-bromo-4-(piperidin-4-ylmethylamino)-1H-pyrimidin-6-one
CID 136977748
8-[[(2S)-1-hydroxypropan-2-yl]amino]-6-[(4-methyl-2-pyridinyl)amino]-2-propan-2-yl-2,7-naphthyridin-1-one
CID 58167037

Frequently Asked Questions

What is the IUPAC name of 6-[(4-methyl-2-pyridinyl)amino]-8-(piperidin-4-ylmethylamino)-2H-2,7-naphthyridin-1-one?
The IUPAC name of 6-[(4-methyl-2-pyridinyl)amino]-8-(piperidin-4-ylmethylamino)-2H-2,7-naphthyridin-1-one (CID 66925452) is 6-[(4-methyl-2-pyridinyl)amino]-8-(piperidin-4-ylmethylamino)-2H-2,7-naphthyridin-1-one.
What is the SMILES notation for 6-[(4-methyl-2-pyridinyl)amino]-8-(piperidin-4-ylmethylamino)-2H-2,7-naphthyridin-1-one?
The canonical SMILES for 6-[(4-methyl-2-pyridinyl)amino]-8-(piperidin-4-ylmethylamino)-2H-2,7-naphthyridin-1-one is Cc1ccnc(Nc2cc3cc[nH]c(=O)c3c(NCC3CCNCC3)n2)c1.
What is the InChIKey of 6-[(4-methyl-2-pyridinyl)amino]-8-(piperidin-4-ylmethylamino)-2H-2,7-naphthyridin-1-one?
The InChIKey is LKTBIYGQHSZMQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6O/c1-13-2-8-22-16(10-13)25-17-11-15-5-9-23-20(27)18(15)19(26-17)24-12-14-3-6-21-7-4-14/h2,5,8-11,14,21H,3-4,6-7,12H2,1H3,(H,23,27)(H2,22,24,25,26).
What are the key properties of 6-[(4-methyl-2-pyridinyl)amino]-8-(piperidin-4-ylmethylamino)-2H-2,7-naphthyridin-1-one?
6-[(4-methyl-2-pyridinyl)amino]-8-(piperidin-4-ylmethylamino)-2H-2,7-naphthyridin-1-one has a molecular weight of 364.45 g/mol, XLogP of 2.78, 5 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-methyl-2-pyridinyl)amino]-8-(piperidin-4-ylmethylamino)-2H-2,7-naphthyridin-1-one is sourced from PubChem (CID 66925452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).