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

C19H27N5O — CID 657712

IUPAC7-methyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile
SMILESCN1CCc2c(C#N)c(N3CCCCC3)nc(N3CCOCC3)c2C1
InChIInChI=1S/C19H27N5O/c1-22-8-5-15-16(13-20)18(23-6-3-2-4-7-23)21-19(17(15)14-22)24-9-11-25-12-10-24/h2-12,14H2,1H3
InChIKeyVRSFVJAPIASHFH-UHFFFAOYSA-N
MW341.46 g/mol
LogP1.77
Rot. Bonds2

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

7-methyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile (PubChem CID 657712) has the molecular formula C19H27N5O and a molecular weight of 341.46 g/mol. Its IUPAC name is 7-methyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile.

Molecular Properties

Compound Name7-methyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile
PubChem CID657712
Molecular FormulaC19H27N5O
Molecular Weight341.46 g/mol
Exact Mass341.22
IUPAC Name7-methyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile
SMILESCN1CCc2c(C#N)c(N3CCCCC3)nc(N3CCOCC3)c2C1
InChIInChI=1S/C19H27N5O/c1-22-8-5-15-16(13-20)18(23-6-3-2-4-7-23)21-19(17(15)14-22)24-9-11-25-12-10-24/h2-12,14H2,1H3
InChIKeyVRSFVJAPIASHFH-UHFFFAOYSA-N
XLogP1.77
TPSA55.63 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.46
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile?
The IUPAC name of 7-methyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile (CID 657712) is 7-methyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile.
What is the SMILES notation for 7-methyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile?
The canonical SMILES for 7-methyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile is CN1CCc2c(C#N)c(N3CCCCC3)nc(N3CCOCC3)c2C1.
What is the InChIKey of 7-methyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile?
The InChIKey is VRSFVJAPIASHFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O/c1-22-8-5-15-16(13-20)18(23-6-3-2-4-7-23)21-19(17(15)14-22)24-9-11-25-12-10-24/h2-12,14H2,1H3.
What are the key properties of 7-methyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile?
7-methyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile has a molecular weight of 341.46 g/mol, XLogP of 1.77, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-1-morpholin-4-yl-3-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile is sourced from PubChem (CID 657712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).