N-[2-(2-methyl-1,3-oxazol-5-yl)-1,6-naphthyridin-7-yl]-4-morpholin-4-ylcyclohexane-1-carboxamide

C23H27N5O3 — CID 138588296

IUPACN-[2-(2-methyl-1,3-oxazol-5-yl)-1,6-naphthyridin-7-yl]-4-morpholin-4-ylcyclohexane-1-carboxamide
SMILESCc1ncc(-c2ccc3cnc(NC(=O)C4CCC(N5CCOCC5)CC4)cc3n2)o1
InChIInChI=1S/C23H27N5O3/c1-15-24-14-21(31-15)19-7-4-17-13-25-22(12-20(17)26-19)27-23(29)16-2-5-18(6-3-16)28-8-10-30-11-9-28/h4,7,12-14,16,18H,2-3,5-6,8-11H2,1H3,(H,25,27,29)
InChIKeyAPZBMTQDEQIILP-UHFFFAOYSA-N
MW421.50 g/mol
LogP3.42
Rot. Bonds4

About N-[2-(2-methyl-1,3-oxazol-5-yl)-1,6-naphthyridin-7-yl]-4-morpholin-4-ylcyclohexane-1-carboxamide

N-[2-(2-methyl-1,3-oxazol-5-yl)-1,6-naphthyridin-7-yl]-4-morpholin-4-ylcyclohexane-1-carboxamide (PubChem CID 138588296) has the molecular formula C23H27N5O3 and a molecular weight of 421.50 g/mol. Its IUPAC name is N-[2-(2-methyl-1,3-oxazol-5-yl)-1,6-naphthyridin-7-yl]-4-morpholin-4-ylcyclohexane-1-carboxamide.

Molecular Properties

Compound NameN-[2-(2-methyl-1,3-oxazol-5-yl)-1,6-naphthyridin-7-yl]-4-morpholin-4-ylcyclohexane-1-carboxamide
PubChem CID138588296
Molecular FormulaC23H27N5O3
Molecular Weight421.50 g/mol
Exact Mass421.21
IUPAC NameN-[2-(2-methyl-1,3-oxazol-5-yl)-1,6-naphthyridin-7-yl]-4-morpholin-4-ylcyclohexane-1-carboxamide
SMILESCc1ncc(-c2ccc3cnc(NC(=O)C4CCC(N5CCOCC5)CC4)cc3n2)o1
InChIInChI=1S/C23H27N5O3/c1-15-24-14-21(31-15)19-7-4-17-13-25-22(12-20(17)26-19)27-23(29)16-2-5-18(6-3-16)28-8-10-30-11-9-28/h4,7,12-14,16,18H,2-3,5-6,8-11H2,1H3,(H,25,27,29)
InChIKeyAPZBMTQDEQIILP-UHFFFAOYSA-N
XLogP3.42
TPSA93.38 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.50
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[2-(2-methyl-1,3-oxazol-5-yl)-1,6-naphthyridin-7-yl]-4-morpholin-4-ylcyclohexane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methyl-1,3-oxazol-5-yl)-1,6-naphthyridin-7-yl]-4-morpholin-4-ylcyclohexane-1-carboxamide?
The IUPAC name of N-[2-(2-methyl-1,3-oxazol-5-yl)-1,6-naphthyridin-7-yl]-4-morpholin-4-ylcyclohexane-1-carboxamide (CID 138588296) is N-[2-(2-methyl-1,3-oxazol-5-yl)-1,6-naphthyridin-7-yl]-4-morpholin-4-ylcyclohexane-1-carboxamide.
What is the SMILES notation for N-[2-(2-methyl-1,3-oxazol-5-yl)-1,6-naphthyridin-7-yl]-4-morpholin-4-ylcyclohexane-1-carboxamide?
The canonical SMILES for N-[2-(2-methyl-1,3-oxazol-5-yl)-1,6-naphthyridin-7-yl]-4-morpholin-4-ylcyclohexane-1-carboxamide is Cc1ncc(-c2ccc3cnc(NC(=O)C4CCC(N5CCOCC5)CC4)cc3n2)o1.
What is the InChIKey of N-[2-(2-methyl-1,3-oxazol-5-yl)-1,6-naphthyridin-7-yl]-4-morpholin-4-ylcyclohexane-1-carboxamide?
The InChIKey is APZBMTQDEQIILP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N5O3/c1-15-24-14-21(31-15)19-7-4-17-13-25-22(12-20(17)26-19)27-23(29)16-2-5-18(6-3-16)28-8-10-30-11-9-28/h4,7,12-14,16,18H,2-3,5-6,8-11H2,1H3,(H,25,27,29).
What are the key properties of N-[2-(2-methyl-1,3-oxazol-5-yl)-1,6-naphthyridin-7-yl]-4-morpholin-4-ylcyclohexane-1-carboxamide?
N-[2-(2-methyl-1,3-oxazol-5-yl)-1,6-naphthyridin-7-yl]-4-morpholin-4-ylcyclohexane-1-carboxamide has a molecular weight of 421.50 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methyl-1,3-oxazol-5-yl)-1,6-naphthyridin-7-yl]-4-morpholin-4-ylcyclohexane-1-carboxamide is sourced from PubChem (CID 138588296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).