7-ethyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile

C20H29N5O — CID 658400

IUPAC7-ethyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile
SMILESCCN1CCc2c(C#N)c(N3CCCCC3)nc(N3CCOCC3)c2C1
InChIInChI=1S/C20H29N5O/c1-2-23-9-6-16-17(14-21)19(24-7-4-3-5-8-24)22-20(18(16)15-23)25-10-12-26-13-11-25/h2-13,15H2,1H3
InChIKeyQJZHQABIAZLOIL-UHFFFAOYSA-N
MW355.49 g/mol
LogP2.16
Rot. Bonds3

About 7-ethyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile

7-ethyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile (PubChem CID 658400) has the molecular formula C20H29N5O and a molecular weight of 355.49 g/mol. Its IUPAC name is 7-ethyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile.

Molecular Properties

Compound Name7-ethyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile
PubChem CID658400
Molecular FormulaC20H29N5O
Molecular Weight355.49 g/mol
Exact Mass355.24
IUPAC Name7-ethyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile
SMILESCCN1CCc2c(C#N)c(N3CCCCC3)nc(N3CCOCC3)c2C1
InChIInChI=1S/C20H29N5O/c1-2-23-9-6-16-17(14-21)19(24-7-4-3-5-8-24)22-20(18(16)15-23)25-10-12-26-13-11-25/h2-13,15H2,1H3
InChIKeyQJZHQABIAZLOIL-UHFFFAOYSA-N
XLogP2.16
TPSA55.63 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.49
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-Ethyl-3-morpholin-4-yl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
CID 658975
1-Isopropyl-3-(4-morpholinyl)-5,6,7,8-tetrahydro-4-isoquinolinecarbonitrile
CID 807848
7-cyclohexyl-3-(4-morpholinyl)-1-(1-piperidinyl)-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile
CID 657650
7-Methyl-1-(morpholin-4-yl)-3-(piperidin-1-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile
CID 657712
7-ethyl-1-(2-hydroxyethylamino)-3-morpholin-4-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile
CID 658426
6-[(2-cyanoethyl)sulfanyl]-3,3-dimethyl-8-(morpholin-4-yl)-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
CID 658817
2-Amino-4-(cyanomethyl)-6-morpholin-4-ylpyridine-3,5-dicarbonitrile
CID 4615395
7-Methyl-3-(morpholin-4-yl)-1-[(tetrahydrofuran-2-ylmethyl)amino]-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile
CID 4885904
7-Ethyl-1,3-di-morpholin-4-yl-5,6,7,8-tetrahydro-[2,7]naphthyridine-4-carbonitrile
CID 627101
3-Morpholino-1-propyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
CID 658226
1-Butyl-3-(morpholin-4-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
CID 658242
4-Methyl-2,6-dimorpholin-4-ylpyridine-3-carbonitrile
CID 334860

Frequently Asked Questions

What is the IUPAC name of 7-ethyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile?
The IUPAC name of 7-ethyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile (CID 658400) is 7-ethyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile.
What is the SMILES notation for 7-ethyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile?
The canonical SMILES for 7-ethyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile is CCN1CCc2c(C#N)c(N3CCCCC3)nc(N3CCOCC3)c2C1.
What is the InChIKey of 7-ethyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile?
The InChIKey is QJZHQABIAZLOIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N5O/c1-2-23-9-6-16-17(14-21)19(24-7-4-3-5-8-24)22-20(18(16)15-23)25-10-12-26-13-11-25/h2-13,15H2,1H3.
What are the key properties of 7-ethyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile?
7-ethyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile has a molecular weight of 355.49 g/mol, XLogP of 2.16, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile is sourced from PubChem (CID 658400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).