(2R,6R)-4-(8-cyano-1,7-naphthyridin-5-yl)-6-methyl-N-(4-morpholin-4-ylcyclohexyl)morpholine-2-carboxamide

C25H32N6O3 — CID 146329183

IUPAC(2R,6R)-4-(8-cyano-1,7-naphthyridin-5-yl)-6-methyl-N-(4-morpholin-4-ylcyclohexyl)morpholine-2-carboxamide
SMILESC[C@@H]1CN(c2cnc(C#N)c3ncccc23)C[C@H](C(=O)NC2CCC(N3CCOCC3)CC2)O1
InChIInChI=1S/C25H32N6O3/c1-17-15-31(22-14-28-21(13-26)24-20(22)3-2-8-27-24)16-23(34-17)25(32)29-18-4-6-19(7-5-18)30-9-11-33-12-10-30/h2-3,8,14,17-19,23H,4-7,9-12,15-16H2,1H3,(H,29,32)/t17-,18?,19?,23-/m1/s1
InChIKeyFCOSEIMIQZEYFG-VSILJMIMSA-N
MW464.57 g/mol
LogP1.85
Rot. Bonds4

About (2R,6R)-4-(8-cyano-1,7-naphthyridin-5-yl)-6-methyl-N-(4-morpholin-4-ylcyclohexyl)morpholine-2-carboxamide

(2R,6R)-4-(8-cyano-1,7-naphthyridin-5-yl)-6-methyl-N-(4-morpholin-4-ylcyclohexyl)morpholine-2-carboxamide (PubChem CID 146329183) has the molecular formula C25H32N6O3 and a molecular weight of 464.57 g/mol. Its IUPAC name is (2R,6R)-4-(8-cyano-1,7-naphthyridin-5-yl)-6-methyl-N-(4-morpholin-4-ylcyclohexyl)morpholine-2-carboxamide.

Molecular Properties

Compound Name(2R,6R)-4-(8-cyano-1,7-naphthyridin-5-yl)-6-methyl-N-(4-morpholin-4-ylcyclohexyl)morpholine-2-carboxamide
PubChem CID146329183
Molecular FormulaC25H32N6O3
Molecular Weight464.57 g/mol
Exact Mass464.25
IUPAC Name(2R,6R)-4-(8-cyano-1,7-naphthyridin-5-yl)-6-methyl-N-(4-morpholin-4-ylcyclohexyl)morpholine-2-carboxamide
SMILESC[C@@H]1CN(c2cnc(C#N)c3ncccc23)C[C@H](C(=O)NC2CCC(N3CCOCC3)CC2)O1
InChIInChI=1S/C25H32N6O3/c1-17-15-31(22-14-28-21(13-26)24-20(22)3-2-8-27-24)16-23(34-17)25(32)29-18-4-6-19(7-5-18)30-9-11-33-12-10-30/h2-3,8,14,17-19,23H,4-7,9-12,15-16H2,1H3,(H,29,32)/t17-,18?,19?,23-/m1/s1
InChIKeyFCOSEIMIQZEYFG-VSILJMIMSA-N
XLogP1.85
TPSA103.61 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500464.57
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Launch Full Analysis

Related Compounds

(6R)-4-(8-cyanoquinazolin-5-yl)-6-methyl-N-(4-morpholin-4-ylcyclohexyl)morpholine-2-carboxamide
CID 146329170
(2R,6R)-4-(8-cyanoquinolin-5-yl)-6-methyl-N-(oxetan-3-yl)morpholine-2-carboxamide
CID 118007265
N-(azepan-4-yl)-4-(8-cyanoquinolin-5-yl)-6-methylmorpholine-2-carboxamide
CID 140671730
(6R)-N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-(8-cyanoquinolin-5-yl)-6-methylmorpholine-2-carboxamide
CID 137395366
(2R,6R)-4-(8-cyanoquinolin-5-yl)-N,6-dimethylmorpholine-2-carboxamide
CID 118007139
(2R,6R)-N-(2-azaspiro[3.3]heptan-6-yl)-4-(8-cyanoquinolin-5-yl)-6-methylmorpholine-2-carboxamide
CID 118006748
N-[(1R,5R)-3-azabicyclo[3.1.0]hexan-6-yl]-4-(8-cyanoquinolin-5-yl)-6-methylmorpholine-2-carboxamide
CID 140735605
N-(3-azabicyclo[3.1.0]hexan-6-yl)-4-(8-cyanoquinolin-5-yl)-6-methylmorpholine-2-carboxamide;hydrochloride
CID 140671765
5-[(2R,6R)-2-[(3S)-3-aminopyrrolidine-1-carbonyl]-6-methylmorpholin-4-yl]quinoline-8-carbonitrile
CID 118007214
(2S,6S)-4-(8-cyanoquinolin-5-yl)-N-[(3R,4S)-4-fluoropyrrolidin-3-yl]-6-methylmorpholine-2-carboxamide
CID 154803648
N-[[(2S,6R)-4-(8-cyano-1,7-naphthyridin-5-yl)-6-methylmorpholin-2-yl]methyl]-3-fluoro-1-methylpyrrolidine-3-carboxamide
CID 162468277
(3R)-N-[[(2S,6R)-4-(8-cyano-1,7-naphthyridin-5-yl)-6-methylmorpholin-2-yl]methyl]-3-fluoro-1-methylpyrrolidine-3-carboxamide
CID 146329602

Frequently Asked Questions

What is the IUPAC name of (2R,6R)-4-(8-cyano-1,7-naphthyridin-5-yl)-6-methyl-N-(4-morpholin-4-ylcyclohexyl)morpholine-2-carboxamide?
The IUPAC name of (2R,6R)-4-(8-cyano-1,7-naphthyridin-5-yl)-6-methyl-N-(4-morpholin-4-ylcyclohexyl)morpholine-2-carboxamide (CID 146329183) is (2R,6R)-4-(8-cyano-1,7-naphthyridin-5-yl)-6-methyl-N-(4-morpholin-4-ylcyclohexyl)morpholine-2-carboxamide.
What is the SMILES notation for (2R,6R)-4-(8-cyano-1,7-naphthyridin-5-yl)-6-methyl-N-(4-morpholin-4-ylcyclohexyl)morpholine-2-carboxamide?
The canonical SMILES for (2R,6R)-4-(8-cyano-1,7-naphthyridin-5-yl)-6-methyl-N-(4-morpholin-4-ylcyclohexyl)morpholine-2-carboxamide is C[C@@H]1CN(c2cnc(C#N)c3ncccc23)C[C@H](C(=O)NC2CCC(N3CCOCC3)CC2)O1.
What is the InChIKey of (2R,6R)-4-(8-cyano-1,7-naphthyridin-5-yl)-6-methyl-N-(4-morpholin-4-ylcyclohexyl)morpholine-2-carboxamide?
The InChIKey is FCOSEIMIQZEYFG-VSILJMIMSA-N. The full InChI is InChI=1S/C25H32N6O3/c1-17-15-31(22-14-28-21(13-26)24-20(22)3-2-8-27-24)16-23(34-17)25(32)29-18-4-6-19(7-5-18)30-9-11-33-12-10-30/h2-3,8,14,17-19,23H,4-7,9-12,15-16H2,1H3,(H,29,32)/t17-,18?,19?,23-/m1/s1.
What are the key properties of (2R,6R)-4-(8-cyano-1,7-naphthyridin-5-yl)-6-methyl-N-(4-morpholin-4-ylcyclohexyl)morpholine-2-carboxamide?
(2R,6R)-4-(8-cyano-1,7-naphthyridin-5-yl)-6-methyl-N-(4-morpholin-4-ylcyclohexyl)morpholine-2-carboxamide has a molecular weight of 464.57 g/mol, XLogP of 1.85, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6R)-4-(8-cyano-1,7-naphthyridin-5-yl)-6-methyl-N-(4-morpholin-4-ylcyclohexyl)morpholine-2-carboxamide is sourced from PubChem (CID 146329183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).