N-[(1-hydroxycyclopentyl)methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide

C18H27N3O2 — CID 111332971

IUPACN-[(1-hydroxycyclopentyl)methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
SMILESCC1CCN(c2ccc(C(=O)NCC3(O)CCCC3)cn2)CC1
InChIInChI=1S/C18H27N3O2/c1-14-6-10-21(11-7-14)16-5-4-15(12-19-16)17(22)20-13-18(23)8-2-3-9-18/h4-5,12,14,23H,2-3,6-11,13H2,1H3,(H,20,22)
InChIKeyAGOOYLNPPYBDJJ-UHFFFAOYSA-N
MW317.43 g/mol
LogP2.35
Rot. Bonds4

About N-[(1-hydroxycyclopentyl)methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide

N-[(1-hydroxycyclopentyl)methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide (PubChem CID 111332971) has the molecular formula C18H27N3O2 and a molecular weight of 317.43 g/mol. Its IUPAC name is N-[(1-hydroxycyclopentyl)methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(1-hydroxycyclopentyl)methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
PubChem CID111332971
Molecular FormulaC18H27N3O2
Molecular Weight317.43 g/mol
Exact Mass317.21
IUPAC NameN-[(1-hydroxycyclopentyl)methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
SMILESCC1CCN(c2ccc(C(=O)NCC3(O)CCCC3)cn2)CC1
InChIInChI=1S/C18H27N3O2/c1-14-6-10-21(11-7-14)16-5-4-15(12-19-16)17(22)20-13-18(23)8-2-3-9-18/h4-5,12,14,23H,2-3,6-11,13H2,1H3,(H,20,22)
InChIKeyAGOOYLNPPYBDJJ-UHFFFAOYSA-N
XLogP2.35
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-(methylamino)cyclopropyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 167828040
N-[[1-[2-(methylamino)-2-oxoethyl]cyclohexyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 146136407
N-[2-(methylamino)propyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;dihydrochloride
CID 120827370
6-bromo-N-[(1-hydroxy-4-methylcyclohexyl)methyl]pyridine-3-carboxamide
CID 66464153
N-(2-amino-2-ethylbutyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;dihydrochloride
CID 119641202
5-N-[[6-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]pyridine-2,5-dicarboxamide
CID 86859111
N-[1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 126780940
N-[(1-hydroxy-4-methylcyclohexyl)methyl]-6-methoxypyridine-3-carboxamide
CID 65120212
N-[(1-hydroxycycloheptyl)methyl]-6-imidazol-1-ylpyridine-3-carboxamide
CID 111428654
6-(4-methylpiperidin-1-yl)-N-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide
CID 146150272
N-(2-amino-2-phenylethyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 119528228
N-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 109152569

Frequently Asked Questions

What is the IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide (CID 111332971) is N-[(1-hydroxycyclopentyl)methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-[(1-hydroxycyclopentyl)methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The canonical SMILES for N-[(1-hydroxycyclopentyl)methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide is CC1CCN(c2ccc(C(=O)NCC3(O)CCCC3)cn2)CC1.
What is the InChIKey of N-[(1-hydroxycyclopentyl)methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The InChIKey is AGOOYLNPPYBDJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O2/c1-14-6-10-21(11-7-14)16-5-4-15(12-19-16)17(22)20-13-18(23)8-2-3-9-18/h4-5,12,14,23H,2-3,6-11,13H2,1H3,(H,20,22).
What are the key properties of N-[(1-hydroxycyclopentyl)methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
N-[(1-hydroxycyclopentyl)methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide has a molecular weight of 317.43 g/mol, XLogP of 2.35, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-hydroxycyclopentyl)methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 111332971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).