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

C24H35N5O — CID 657650

IUPAC7-cyclohexyl-3-morpholin-4-yl-1-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile
SMILESN#Cc1c(N2CCOCC2)nc(N2CCCCC2)c2c1CCN(C1CCCCC1)C2
InChIInChI=1S/C24H35N5O/c25-17-21-20-9-12-29(19-7-3-1-4-8-19)18-22(20)24(27-10-5-2-6-11-27)26-23(21)28-13-15-30-16-14-28/h19H,1-16,18H2
InChIKeyLMHRUVOWZDZKLT-UHFFFAOYSA-N
MW409.58 g/mol
LogP3.47
Rot. Bonds3

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

7-cyclohexyl-3-morpholin-4-yl-1-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile (PubChem CID 657650) has the molecular formula C24H35N5O and a molecular weight of 409.58 g/mol. Its IUPAC name is 7-cyclohexyl-3-morpholin-4-yl-1-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile.

Molecular Properties

Compound Name7-cyclohexyl-3-morpholin-4-yl-1-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile
PubChem CID657650
Molecular FormulaC24H35N5O
Molecular Weight409.58 g/mol
Exact Mass409.28
IUPAC Name7-cyclohexyl-3-morpholin-4-yl-1-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile
SMILESN#Cc1c(N2CCOCC2)nc(N2CCCCC2)c2c1CCN(C1CCCCC1)C2
InChIInChI=1S/C24H35N5O/c25-17-21-20-9-12-29(19-7-3-1-4-8-19)18-22(20)24(27-10-5-2-6-11-27)26-23(21)28-13-15-30-16-14-28/h19H,1-16,18H2
InChIKeyLMHRUVOWZDZKLT-UHFFFAOYSA-N
XLogP3.47
TPSA55.63 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.58
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-cyclohexyl-3-morpholin-4-yl-1-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile?
The IUPAC name of 7-cyclohexyl-3-morpholin-4-yl-1-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile (CID 657650) is 7-cyclohexyl-3-morpholin-4-yl-1-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile.
What is the SMILES notation for 7-cyclohexyl-3-morpholin-4-yl-1-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile?
The canonical SMILES for 7-cyclohexyl-3-morpholin-4-yl-1-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile is N#Cc1c(N2CCOCC2)nc(N2CCCCC2)c2c1CCN(C1CCCCC1)C2.
What is the InChIKey of 7-cyclohexyl-3-morpholin-4-yl-1-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile?
The InChIKey is LMHRUVOWZDZKLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H35N5O/c25-17-21-20-9-12-29(19-7-3-1-4-8-19)18-22(20)24(27-10-5-2-6-11-27)26-23(21)28-13-15-30-16-14-28/h19H,1-16,18H2.
What are the key properties of 7-cyclohexyl-3-morpholin-4-yl-1-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile?
7-cyclohexyl-3-morpholin-4-yl-1-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile has a molecular weight of 409.58 g/mol, XLogP of 3.47, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-cyclohexyl-3-morpholin-4-yl-1-piperidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile is sourced from PubChem (CID 657650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).