2-[[4-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]cyclohexyl]amino]pyridine-3-carboxamide

C16H21N5O3 — CID 146423182

IUPAC2-[[4-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]cyclohexyl]amino]pyridine-3-carboxamide
SMILESCOCc1nnc(C2CCC(Nc3ncccc3C(N)=O)CC2)o1
InChIInChI=1S/C16H21N5O3/c1-23-9-13-20-21-16(24-13)10-4-6-11(7-5-10)19-15-12(14(17)22)3-2-8-18-15/h2-3,8,10-11H,4-7,9H2,1H3,(H2,17,22)(H,18,19)
InChIKeyXCSVYWFOCSNXER-UHFFFAOYSA-N
MW331.38 g/mol
LogP1.85
Rot. Bonds6

About 2-[[4-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]cyclohexyl]amino]pyridine-3-carboxamide

2-[[4-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]cyclohexyl]amino]pyridine-3-carboxamide (PubChem CID 146423182) has the molecular formula C16H21N5O3 and a molecular weight of 331.38 g/mol. Its IUPAC name is 2-[[4-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]cyclohexyl]amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-[[4-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]cyclohexyl]amino]pyridine-3-carboxamide
PubChem CID146423182
Molecular FormulaC16H21N5O3
Molecular Weight331.38 g/mol
Exact Mass331.16
IUPAC Name2-[[4-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]cyclohexyl]amino]pyridine-3-carboxamide
SMILESCOCc1nnc(C2CCC(Nc3ncccc3C(N)=O)CC2)o1
InChIInChI=1S/C16H21N5O3/c1-23-9-13-20-21-16(24-13)10-4-6-11(7-5-10)19-15-12(14(17)22)3-2-8-18-15/h2-3,8,10-11H,4-7,9H2,1H3,(H2,17,22)(H,18,19)
InChIKeyXCSVYWFOCSNXER-UHFFFAOYSA-N
XLogP1.85
TPSA116.16 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.38
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-[[4-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]cyclohexyl]amino]pyridine-3-carboxamide with MolForge

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Related Compounds

methyl 2-(cyclopropylamino)pyridine-3-carboxylate
CID 60722666
2-[[(3S)-oxolan-3-yl]amino]pyridine-3-carboxamide
CID 139960156
2-(cyclopropylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 84574880
ethyl 2-[(4-carbamoylcyclohexyl)amino]pyridine-3-carboxylate
CID 61044227
2-[(4-hydroxycyclohexyl)methylamino]pyridine-3-carboxamide
CID 114147498
methyl 2-[(1,1-dioxothian-4-yl)amino]pyridine-3-carboxylate
CID 62000677
methyl 2-[(3-methoxycyclopentyl)amino]pyridine-3-carboxylate
CID 103082179
2-[(5-oxopyrrolidin-3-yl)amino]pyridine-3-carboxamide
CID 107143766
2-[(2-methylcyclohexyl)methylamino]pyridine-3-carboxamide
CID 55009920
2-[(3-methoxy-2,2-dimethylcyclobutyl)amino]pyridine-3-carboxamide
CID 103742713
2-(cyclopropylamino)-N-[(4-methoxyphenyl)methyl]pyridine-3-carboxamide
CID 84573928
2-(cyclopropylamino)-N-(3,4-dimethoxyphenyl)pyridine-3-carboxamide
CID 84574680

Frequently Asked Questions

What is the IUPAC name of 2-[[4-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]cyclohexyl]amino]pyridine-3-carboxamide?
The IUPAC name of 2-[[4-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]cyclohexyl]amino]pyridine-3-carboxamide (CID 146423182) is 2-[[4-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]cyclohexyl]amino]pyridine-3-carboxamide.
What is the SMILES notation for 2-[[4-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]cyclohexyl]amino]pyridine-3-carboxamide?
The canonical SMILES for 2-[[4-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]cyclohexyl]amino]pyridine-3-carboxamide is COCc1nnc(C2CCC(Nc3ncccc3C(N)=O)CC2)o1.
What is the InChIKey of 2-[[4-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]cyclohexyl]amino]pyridine-3-carboxamide?
The InChIKey is XCSVYWFOCSNXER-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5O3/c1-23-9-13-20-21-16(24-13)10-4-6-11(7-5-10)19-15-12(14(17)22)3-2-8-18-15/h2-3,8,10-11H,4-7,9H2,1H3,(H2,17,22)(H,18,19).
What are the key properties of 2-[[4-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]cyclohexyl]amino]pyridine-3-carboxamide?
2-[[4-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]cyclohexyl]amino]pyridine-3-carboxamide has a molecular weight of 331.38 g/mol, XLogP of 1.85, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-[5-(methoxymethyl)-1,3,4-oxadiazol-2-yl]cyclohexyl]amino]pyridine-3-carboxamide is sourced from PubChem (CID 146423182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).