5-amino-2-[(2-hydroxycyclohexyl)-methylamino]pyridine-4-carboxamide

C13H20N4O2 — CID 114090686

IUPAC5-amino-2-[(2-hydroxycyclohexyl)-methylamino]pyridine-4-carboxamide
SMILESCN(c1cc(C(N)=O)c(N)cn1)C1CCCCC1O
InChIInChI=1S/C13H20N4O2/c1-17(10-4-2-3-5-11(10)18)12-6-8(13(15)19)9(14)7-16-12/h6-7,10-11,18H,2-5,14H2,1H3,(H2,15,19)
InChIKeyCVESLJBPGLNXSU-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.50
Rot. Bonds3

About 5-amino-2-[(2-hydroxycyclohexyl)-methylamino]pyridine-4-carboxamide

5-amino-2-[(2-hydroxycyclohexyl)-methylamino]pyridine-4-carboxamide (PubChem CID 114090686) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 5-amino-2-[(2-hydroxycyclohexyl)-methylamino]pyridine-4-carboxamide.

Molecular Properties

Compound Name5-amino-2-[(2-hydroxycyclohexyl)-methylamino]pyridine-4-carboxamide
PubChem CID114090686
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name5-amino-2-[(2-hydroxycyclohexyl)-methylamino]pyridine-4-carboxamide
SMILESCN(c1cc(C(N)=O)c(N)cn1)C1CCCCC1O
InChIInChI=1S/C13H20N4O2/c1-17(10-4-2-3-5-11(10)18)12-6-8(13(15)19)9(14)7-16-12/h6-7,10-11,18H,2-5,14H2,1H3,(H2,15,19)
InChIKeyCVESLJBPGLNXSU-UHFFFAOYSA-N
XLogP0.50
TPSA105.47 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(4-Hydroxycyclohexyl)amino]-5,11-dimethylpyrido[4,3-b][1,4]benzodiazepin-6-one
CID 118352301
3-[(4,6-dimethyl-2-pyridinyl)amino]-5-[[(1R,2S)-2-hydroxycyclohexyl]amino]pyridine-2-carboxamide
CID 118733357
6-anilino-4-[[(2S)-1-hydroxy-3-phenylpropan-2-yl]amino]pyridine-3-carboxamide
CID 137659999
5-[(4-Hydroxycyclohexyl)amino]-3-methyl-7-(pyrazin-2-ylamino)pyrido[4,3-d]pyrimidin-4-one
CID 66959898
2-(2-Hydroxycyclopropyl)-7-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-10-one
CID 154699505
N-(1-aminoethylidene)-6-[(3R,4R)-4-(cyclohexylamino)-3-hydroxypiperidin-1-yl]-5-methylpyridine-3-carboxamide
CID 118263746
6-[[2-(3-hydroxypyrrolidin-1-yl)-1-phenylethyl]-methylamino]-N-propylpyridine-3-carboxamide
CID 44214495
2-[2-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethylamino]pyridine-3-carboxamide
CID 164642989
2-[3-[(2R)-2-(hydroxymethyl)piperidin-1-yl]propylamino]-N-propan-2-ylpyridine-4-carboxamide
CID 171359720
2-(1-fluorocyclopropyl)-6-[2-hydroxyethyl(methyl)amino]-3H-pyrido[3,4-d]pyrimidin-4-one
CID 136988046
6-(2-Fluoropropan-2-ylamino)-4-[(3-hydroxycyclohexyl)amino]pyridine-3-carboxamide
CID 167147033
N-[(2S)-4-[4-(aminomethyl)-6-oxo-1H-pyridin-3-yl]-2-hydroxybutyl]-2-(cyclobutylamino)-5-fluoropyridine-4-carboxamide
CID 169649775

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-[(2-hydroxycyclohexyl)-methylamino]pyridine-4-carboxamide?
The IUPAC name of 5-amino-2-[(2-hydroxycyclohexyl)-methylamino]pyridine-4-carboxamide (CID 114090686) is 5-amino-2-[(2-hydroxycyclohexyl)-methylamino]pyridine-4-carboxamide.
What is the SMILES notation for 5-amino-2-[(2-hydroxycyclohexyl)-methylamino]pyridine-4-carboxamide?
The canonical SMILES for 5-amino-2-[(2-hydroxycyclohexyl)-methylamino]pyridine-4-carboxamide is CN(c1cc(C(N)=O)c(N)cn1)C1CCCCC1O.
What is the InChIKey of 5-amino-2-[(2-hydroxycyclohexyl)-methylamino]pyridine-4-carboxamide?
The InChIKey is CVESLJBPGLNXSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-17(10-4-2-3-5-11(10)18)12-6-8(13(15)19)9(14)7-16-12/h6-7,10-11,18H,2-5,14H2,1H3,(H2,15,19).
What are the key properties of 5-amino-2-[(2-hydroxycyclohexyl)-methylamino]pyridine-4-carboxamide?
5-amino-2-[(2-hydroxycyclohexyl)-methylamino]pyridine-4-carboxamide has a molecular weight of 264.33 g/mol, XLogP of 0.50, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-[(2-hydroxycyclohexyl)-methylamino]pyridine-4-carboxamide is sourced from PubChem (CID 114090686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).