N-[3-(2-methyl-1,3-oxazol-4-yl)-1,7-naphthyridin-6-yl]-4-(4-methylpiperazin-1-yl)cyclohexane-1-carboxamide

C24H30N6O2 — CID 138588117

IUPACN-[3-(2-methyl-1,3-oxazol-4-yl)-1,7-naphthyridin-6-yl]-4-(4-methylpiperazin-1-yl)cyclohexane-1-carboxamide
SMILESCc1nc(-c2cnc3cnc(NC(=O)C4CCC(N5CCN(C)CC5)CC4)cc3c2)co1
InChIInChI=1S/C24H30N6O2/c1-16-27-22(15-32-16)19-11-18-12-23(26-14-21(18)25-13-19)28-24(31)17-3-5-20(6-4-17)30-9-7-29(2)8-10-30/h11-15,17,20H,3-10H2,1-2H3,(H,26,28,31)
InChIKeyNYXQGGWCUGKRFG-UHFFFAOYSA-N
MW434.54 g/mol
LogP3.34
Rot. Bonds4

About N-[3-(2-methyl-1,3-oxazol-4-yl)-1,7-naphthyridin-6-yl]-4-(4-methylpiperazin-1-yl)cyclohexane-1-carboxamide

N-[3-(2-methyl-1,3-oxazol-4-yl)-1,7-naphthyridin-6-yl]-4-(4-methylpiperazin-1-yl)cyclohexane-1-carboxamide (PubChem CID 138588117) has the molecular formula C24H30N6O2 and a molecular weight of 434.54 g/mol. Its IUPAC name is N-[3-(2-methyl-1,3-oxazol-4-yl)-1,7-naphthyridin-6-yl]-4-(4-methylpiperazin-1-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound NameN-[3-(2-methyl-1,3-oxazol-4-yl)-1,7-naphthyridin-6-yl]-4-(4-methylpiperazin-1-yl)cyclohexane-1-carboxamide
PubChem CID138588117
Molecular FormulaC24H30N6O2
Molecular Weight434.54 g/mol
Exact Mass434.24
IUPAC NameN-[3-(2-methyl-1,3-oxazol-4-yl)-1,7-naphthyridin-6-yl]-4-(4-methylpiperazin-1-yl)cyclohexane-1-carboxamide
SMILESCc1nc(-c2cnc3cnc(NC(=O)C4CCC(N5CCN(C)CC5)CC4)cc3c2)co1
InChIInChI=1S/C24H30N6O2/c1-16-27-22(15-32-16)19-11-18-12-23(26-14-21(18)25-13-19)28-24(31)17-3-5-20(6-4-17)30-9-7-29(2)8-10-30/h11-15,17,20H,3-10H2,1-2H3,(H,26,28,31)
InChIKeyNYXQGGWCUGKRFG-UHFFFAOYSA-N
XLogP3.34
TPSA87.39 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.54
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-[3-[3-(Quinolin-2-ylamino)cyclobutyl]oxypyrazin-2-yl]pyridine-2-carboxamide
CID 58548613
N-[6-(2-methyl-1,3-oxazol-4-yl)isoquinolin-3-yl]-4-(4-methylpiperazin-1-yl)cyclohexane-1-carboxamide
CID 138559199
6-[2-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-1,3-oxazol-4-yl]-N-[3-(trifluoromethyl)phenyl]pyridin-3-amine
CID 25073588
N-[3-(5-fluoro-3-pyridinyl)-1,7-naphthyridin-6-yl]-2-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide
CID 138587272
N-[3-(5-fluoro-3-pyridinyl)-1,7-naphthyridin-6-yl]-2-(1-methylpiperidin-4-yl)-1,3-oxazole-4-carboxamide
CID 138589125
N'-[2-amino-6-[2-[4-[2-fluoro-5-(2-methyl-1,3-oxazol-4-yl)phenyl]piperazin-1-yl]ethylamino]-5-methanimidoylpyrimidin-4-yl]-3-methylpyrazine-2-carboximidamide
CID 143429243
4-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[5-(8-methyl-3,8-diazabicyclo[3.2.1]octan-3-yl)-2-pyridinyl]-1,3-oxazole-2-carboxamide
CID 172187401
1-[4-(2-Methyl-oxazol-4-yl)phenyl]-3-[2-(4-methyl-piperazin-1-yl)-pyridin-3-ylmethyl]-piperidin-2-one
CID 11510597
1-[4-(2-Methyl-1,3-oxazol-4-yl)phenyl]-3-[[2-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]pyrrolidin-2-one
CID 11524818
3-[[2-(4-Methylpiperazin-1-yl)-3-pyridinyl]methyl]-1-[4-(2-propan-2-yl-1,3-oxazol-4-yl)phenyl]piperidin-2-one
CID 11590979
1-[4-(2-Tert-butyl-1,3-oxazol-4-yl)phenyl]-3-[[2-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]piperidin-2-one
CID 11677519
8-(Cyclopropylmethyl)-6-[3-methyl-5-(1,3-oxazol-4-yl)-2-pyridinyl]-2-[4-(4-methylpiperazin-1-yl)anilino]pyrido[2,3-d]pyrimidin-7-one
CID 90210791

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-methyl-1,3-oxazol-4-yl)-1,7-naphthyridin-6-yl]-4-(4-methylpiperazin-1-yl)cyclohexane-1-carboxamide?
The IUPAC name of N-[3-(2-methyl-1,3-oxazol-4-yl)-1,7-naphthyridin-6-yl]-4-(4-methylpiperazin-1-yl)cyclohexane-1-carboxamide (CID 138588117) is N-[3-(2-methyl-1,3-oxazol-4-yl)-1,7-naphthyridin-6-yl]-4-(4-methylpiperazin-1-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for N-[3-(2-methyl-1,3-oxazol-4-yl)-1,7-naphthyridin-6-yl]-4-(4-methylpiperazin-1-yl)cyclohexane-1-carboxamide?
The canonical SMILES for N-[3-(2-methyl-1,3-oxazol-4-yl)-1,7-naphthyridin-6-yl]-4-(4-methylpiperazin-1-yl)cyclohexane-1-carboxamide is Cc1nc(-c2cnc3cnc(NC(=O)C4CCC(N5CCN(C)CC5)CC4)cc3c2)co1.
What is the InChIKey of N-[3-(2-methyl-1,3-oxazol-4-yl)-1,7-naphthyridin-6-yl]-4-(4-methylpiperazin-1-yl)cyclohexane-1-carboxamide?
The InChIKey is NYXQGGWCUGKRFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N6O2/c1-16-27-22(15-32-16)19-11-18-12-23(26-14-21(18)25-13-19)28-24(31)17-3-5-20(6-4-17)30-9-7-29(2)8-10-30/h11-15,17,20H,3-10H2,1-2H3,(H,26,28,31).
What are the key properties of N-[3-(2-methyl-1,3-oxazol-4-yl)-1,7-naphthyridin-6-yl]-4-(4-methylpiperazin-1-yl)cyclohexane-1-carboxamide?
N-[3-(2-methyl-1,3-oxazol-4-yl)-1,7-naphthyridin-6-yl]-4-(4-methylpiperazin-1-yl)cyclohexane-1-carboxamide has a molecular weight of 434.54 g/mol, XLogP of 3.34, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-methyl-1,3-oxazol-4-yl)-1,7-naphthyridin-6-yl]-4-(4-methylpiperazin-1-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 138588117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).