1-[3-[5-amino-2-(cyclohexylamino)-4-pyridinyl]-2,6-naphthyridin-1-yl]-N-propan-2-ylpiperidine-4-carboxamide

C28H37N7O — CID 67026658

IUPAC1-[3-[5-amino-2-(cyclohexylamino)-4-pyridinyl]-2,6-naphthyridin-1-yl]-N-propan-2-ylpiperidine-4-carboxamide
SMILESCC(C)NC(=O)C1CCN(c2nc(-c3cc(NC4CCCCC4)ncc3N)cc3cnccc23)CC1
InChIInChI=1S/C28H37N7O/c1-18(2)32-28(36)19-9-12-35(13-10-19)27-22-8-11-30-16-20(22)14-25(34-27)23-15-26(31-17-24(23)29)33-21-6-4-3-5-7-21/h8,11,14-19,21H,3-7,9-10,12-13,29H2,1-2H3,(H,31,33)(H,32,36)
InChIKeyCUZPPBDYJILZBJ-UHFFFAOYSA-N
MW487.65 g/mol
LogP4.76
Rot. Bonds6

About 1-[3-[5-amino-2-(cyclohexylamino)-4-pyridinyl]-2,6-naphthyridin-1-yl]-N-propan-2-ylpiperidine-4-carboxamide

1-[3-[5-amino-2-(cyclohexylamino)-4-pyridinyl]-2,6-naphthyridin-1-yl]-N-propan-2-ylpiperidine-4-carboxamide (PubChem CID 67026658) has the molecular formula C28H37N7O and a molecular weight of 487.65 g/mol. Its IUPAC name is 1-[3-[5-amino-2-(cyclohexylamino)-4-pyridinyl]-2,6-naphthyridin-1-yl]-N-propan-2-ylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-[3-[5-amino-2-(cyclohexylamino)-4-pyridinyl]-2,6-naphthyridin-1-yl]-N-propan-2-ylpiperidine-4-carboxamide
PubChem CID67026658
Molecular FormulaC28H37N7O
Molecular Weight487.65 g/mol
Exact Mass487.31
IUPAC Name1-[3-[5-amino-2-(cyclohexylamino)-4-pyridinyl]-2,6-naphthyridin-1-yl]-N-propan-2-ylpiperidine-4-carboxamide
SMILESCC(C)NC(=O)C1CCN(c2nc(-c3cc(NC4CCCCC4)ncc3N)cc3cnccc23)CC1
InChIInChI=1S/C28H37N7O/c1-18(2)32-28(36)19-9-12-35(13-10-19)27-22-8-11-30-16-20(22)14-25(34-27)23-15-26(31-17-24(23)29)33-21-6-4-3-5-7-21/h8,11,14-19,21H,3-7,9-10,12-13,29H2,1-2H3,(H,31,33)(H,32,36)
InChIKeyCUZPPBDYJILZBJ-UHFFFAOYSA-N
XLogP4.76
TPSA109.06 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500487.65
LogP ≤ 54.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 1-[3-[5-amino-2-(cyclohexylamino)-4-pyridinyl]-2,6-naphthyridin-1-yl]-N-propan-2-ylpiperidine-4-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

Wnt-974
CID 46926973
1H-Pyrrolo(3,2-c)pyridine-1-acetamide, 4-(2-methyl-4-pyridinyl)-N-(5-(2-pyrazinyl)-2-pyridinyl)-
CID 121280694
Cyclohexyl-(4-(1-piperazin-1-yl(2,6)naphthyridin-3-yl)pyridin-2-yl)amine
CID 25020250
Gnf6231
CID 46927297
1-Phenyl-3-(3-(pyridin-2-yl)isoquinolin-1-yl)urea
CID 10640891
1-({4-[2-(methylsulfanyl)-6-phenylpyrido[2,3-d]pyrimidin-7-yl]phenyl}methyl)-N-(pyridin-4-yl)piperidine-4-carboxamide
CID 11592032
2-Methyl-N~1~-[3-(Pyridin-4-Yl)-2,6-Naphthyridin-1-Yl]propane-1,2-Diamine
CID 24996161
7-[6-(Dimethylamino)pyridin-3-Yl]-~{n}-[[(3~{s})-Piperidin-3-Yl]methyl]pyrido[3,4-B]pyrazin-5-Amine
CID 66555698
3-Methyl-5-(5-methylpyridin-3-yl)-8-[(piperidin-4-yl)amino]-1,2-dihydro-1,7-naphthyridin-2-one
CID 91827383
(3~{R})-6-[(4-isoquinolin-4-ylpyrimidin-2-yl)amino]-1,3-dimethyl-4-propan-2-yl-3~{H}-quinoxalin-2-one
CID 155289199
4-(1-Piperazin-1-yl[2,6]naphthyridin-3-yl)pyridin-2-yl](tetrahydropyran-4-yl)amine
CID 46899901
{4-[1-(4-Isobutylpiperazin-1-yl)[2,6]naphthyridin-3-yl]pyridin-2-yl}(tetrahydropyran-4-yl)amine
CID 46899902

Frequently Asked Questions

What is the IUPAC name of 1-[3-[5-amino-2-(cyclohexylamino)-4-pyridinyl]-2,6-naphthyridin-1-yl]-N-propan-2-ylpiperidine-4-carboxamide?
The IUPAC name of 1-[3-[5-amino-2-(cyclohexylamino)-4-pyridinyl]-2,6-naphthyridin-1-yl]-N-propan-2-ylpiperidine-4-carboxamide (CID 67026658) is 1-[3-[5-amino-2-(cyclohexylamino)-4-pyridinyl]-2,6-naphthyridin-1-yl]-N-propan-2-ylpiperidine-4-carboxamide.
What is the SMILES notation for 1-[3-[5-amino-2-(cyclohexylamino)-4-pyridinyl]-2,6-naphthyridin-1-yl]-N-propan-2-ylpiperidine-4-carboxamide?
The canonical SMILES for 1-[3-[5-amino-2-(cyclohexylamino)-4-pyridinyl]-2,6-naphthyridin-1-yl]-N-propan-2-ylpiperidine-4-carboxamide is CC(C)NC(=O)C1CCN(c2nc(-c3cc(NC4CCCCC4)ncc3N)cc3cnccc23)CC1.
What is the InChIKey of 1-[3-[5-amino-2-(cyclohexylamino)-4-pyridinyl]-2,6-naphthyridin-1-yl]-N-propan-2-ylpiperidine-4-carboxamide?
The InChIKey is CUZPPBDYJILZBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H37N7O/c1-18(2)32-28(36)19-9-12-35(13-10-19)27-22-8-11-30-16-20(22)14-25(34-27)23-15-26(31-17-24(23)29)33-21-6-4-3-5-7-21/h8,11,14-19,21H,3-7,9-10,12-13,29H2,1-2H3,(H,31,33)(H,32,36).
What are the key properties of 1-[3-[5-amino-2-(cyclohexylamino)-4-pyridinyl]-2,6-naphthyridin-1-yl]-N-propan-2-ylpiperidine-4-carboxamide?
1-[3-[5-amino-2-(cyclohexylamino)-4-pyridinyl]-2,6-naphthyridin-1-yl]-N-propan-2-ylpiperidine-4-carboxamide has a molecular weight of 487.65 g/mol, XLogP of 4.76, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[5-amino-2-(cyclohexylamino)-4-pyridinyl]-2,6-naphthyridin-1-yl]-N-propan-2-ylpiperidine-4-carboxamide is sourced from PubChem (CID 67026658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).