6-[[5-(dimethylcarbamoyl)-2-pyridinyl]amino]-4-[[(1S,3R)-5-hydroxy-2-adamantyl]amino]pyridine-3-carboxamide

C24H30N6O3 — CID 67371262

IUPAC6-[[5-(dimethylcarbamoyl)-2-pyridinyl]amino]-4-[[(1S,3R)-5-hydroxy-2-adamantyl]amino]pyridine-3-carboxamide
SMILESCN(C)C(=O)c1ccc(Nc2cc(NC3[C@@H]4CC5C[C@H]3CC(O)(C5)C4)c(C(N)=O)cn2)nc1
InChIInChI=1S/C24H30N6O3/c1-30(2)23(32)14-3-4-19(26-11-14)29-20-7-18(17(12-27-20)22(25)31)28-21-15-5-13-6-16(21)10-24(33,8-13)9-15/h3-4,7,11-13,15-16,21,33H,5-6,8-10H2,1-2H3,(H2,25,31)(H2,26,27,28,29)/t13?,15-,16+,21?,24?
InChIKeyNFAULUZACKBUQH-AWAYWFHWSA-N
MW450.54 g/mol
LogP2.37
Rot. Bonds6

About 6-[[5-(dimethylcarbamoyl)-2-pyridinyl]amino]-4-[[(1S,3R)-5-hydroxy-2-adamantyl]amino]pyridine-3-carboxamide

6-[[5-(dimethylcarbamoyl)-2-pyridinyl]amino]-4-[[(1S,3R)-5-hydroxy-2-adamantyl]amino]pyridine-3-carboxamide (PubChem CID 67371262) has the molecular formula C24H30N6O3 and a molecular weight of 450.54 g/mol. Its IUPAC name is 6-[[5-(dimethylcarbamoyl)-2-pyridinyl]amino]-4-[[(1S,3R)-5-hydroxy-2-adamantyl]amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[[5-(dimethylcarbamoyl)-2-pyridinyl]amino]-4-[[(1S,3R)-5-hydroxy-2-adamantyl]amino]pyridine-3-carboxamide
PubChem CID67371262
Molecular FormulaC24H30N6O3
Molecular Weight450.54 g/mol
Exact Mass450.24
IUPAC Name6-[[5-(dimethylcarbamoyl)-2-pyridinyl]amino]-4-[[(1S,3R)-5-hydroxy-2-adamantyl]amino]pyridine-3-carboxamide
SMILESCN(C)C(=O)c1ccc(Nc2cc(NC3[C@@H]4CC5C[C@H]3CC(O)(C5)C4)c(C(N)=O)cn2)nc1
InChIInChI=1S/C24H30N6O3/c1-30(2)23(32)14-3-4-19(26-11-14)29-20-7-18(17(12-27-20)22(25)31)28-21-15-5-13-6-16(21)10-24(33,8-13)9-15/h3-4,7,11-13,15-16,21,33H,5-6,8-10H2,1-2H3,(H2,25,31)(H2,26,27,28,29)/t13?,15-,16+,21?,24?
InChIKeyNFAULUZACKBUQH-AWAYWFHWSA-N
XLogP2.37
TPSA133.47 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500450.54
LogP ≤ 52.37
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Analyze 6-[[5-(dimethylcarbamoyl)-2-pyridinyl]amino]-4-[[(1S,3R)-5-hydroxy-2-adamantyl]amino]pyridine-3-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

4-[[(1R,3S)-5-hydroxy-2-adamantyl]amino]-6-(pyrazin-2-ylamino)pyridine-3-carboxamide
CID 67371527
4-[(5-hydroxy-2-adamantyl)amino]-6-(4-methoxyanilino)pyridine-3-carboxamide;toluene
CID 143999950
4-[[(1R,3S)-5-hydroxy-2-adamantyl]amino]-6-[(1-methyl-2-oxo-3,4-dihydroquinolin-7-yl)methyl]pyridine-3-carboxamide
CID 58440359
4-[[(1S,3R)-5-hydroxy-2-adamantyl]amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide;hydrochloride
CID 67998252
4-[(5-hydroxy-2-adamantyl)amino]-1-propan-2-ylpyrrolo[2,3-b]pyridine-5-carboxamide
CID 164744203
4-[[5-(2-cyanoethoxy)-2-adamantyl]amino]-6-(pyrazin-2-ylamino)pyridine-3-carboxamide
CID 77274405
6-[4-(dimethylcarbamoyl)anilino]-4-[[(1R)-1-phenylethyl]amino]pyridine-3-carboxamide
CID 118673045
6-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide
CID 79764561
4-[cyclopentyl(methyl)amino]-6-[4-(dimethylcarbamoyl)anilino]pyridine-3-carboxamide
CID 56970219
6-[[(1R,2R)-2-aminocyclohexyl]amino]-N,N-dimethylpyridine-3-carboxamide
CID 102738868
2-[(5-hydroxy-2-adamantyl)-methylamino]-4-[(2S)-oxolan-2-yl]pyrimidine-5-carboxamide
CID 140541502
4-cyclopropyl-2-[(5-hydroxy-2-adamantyl)-propan-2-ylamino]pyrimidine-5-carboxamide
CID 140541492

Frequently Asked Questions

What is the IUPAC name of 6-[[5-(dimethylcarbamoyl)-2-pyridinyl]amino]-4-[[(1S,3R)-5-hydroxy-2-adamantyl]amino]pyridine-3-carboxamide?
The IUPAC name of 6-[[5-(dimethylcarbamoyl)-2-pyridinyl]amino]-4-[[(1S,3R)-5-hydroxy-2-adamantyl]amino]pyridine-3-carboxamide (CID 67371262) is 6-[[5-(dimethylcarbamoyl)-2-pyridinyl]amino]-4-[[(1S,3R)-5-hydroxy-2-adamantyl]amino]pyridine-3-carboxamide.
What is the SMILES notation for 6-[[5-(dimethylcarbamoyl)-2-pyridinyl]amino]-4-[[(1S,3R)-5-hydroxy-2-adamantyl]amino]pyridine-3-carboxamide?
The canonical SMILES for 6-[[5-(dimethylcarbamoyl)-2-pyridinyl]amino]-4-[[(1S,3R)-5-hydroxy-2-adamantyl]amino]pyridine-3-carboxamide is CN(C)C(=O)c1ccc(Nc2cc(NC3[C@@H]4CC5C[C@H]3CC(O)(C5)C4)c(C(N)=O)cn2)nc1.
What is the InChIKey of 6-[[5-(dimethylcarbamoyl)-2-pyridinyl]amino]-4-[[(1S,3R)-5-hydroxy-2-adamantyl]amino]pyridine-3-carboxamide?
The InChIKey is NFAULUZACKBUQH-AWAYWFHWSA-N. The full InChI is InChI=1S/C24H30N6O3/c1-30(2)23(32)14-3-4-19(26-11-14)29-20-7-18(17(12-27-20)22(25)31)28-21-15-5-13-6-16(21)10-24(33,8-13)9-15/h3-4,7,11-13,15-16,21,33H,5-6,8-10H2,1-2H3,(H2,25,31)(H2,26,27,28,29)/t13?,15-,16+,21?,24?.
What are the key properties of 6-[[5-(dimethylcarbamoyl)-2-pyridinyl]amino]-4-[[(1S,3R)-5-hydroxy-2-adamantyl]amino]pyridine-3-carboxamide?
6-[[5-(dimethylcarbamoyl)-2-pyridinyl]amino]-4-[[(1S,3R)-5-hydroxy-2-adamantyl]amino]pyridine-3-carboxamide has a molecular weight of 450.54 g/mol, XLogP of 2.37, 6 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[5-(dimethylcarbamoyl)-2-pyridinyl]amino]-4-[[(1S,3R)-5-hydroxy-2-adamantyl]amino]pyridine-3-carboxamide is sourced from PubChem (CID 67371262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).