(1-pyridin-2-ylpiperidin-4-yl) N-(5-hydroxy-2-pyridinyl)carbamate

C16H18N4O3 — CID 142622775

IUPAC(1-pyridin-2-ylpiperidin-4-yl) N-(5-hydroxy-2-pyridinyl)carbamate
SMILESO=C(Nc1ccc(O)cn1)OC1CCN(c2ccccn2)CC1
InChIInChI=1S/C16H18N4O3/c21-12-4-5-14(18-11-12)19-16(22)23-13-6-9-20(10-7-13)15-3-1-2-8-17-15/h1-5,8,11,13,21H,6-7,9-10H2,(H,18,19,22)
InChIKeySCQIYRRYVMXCCI-UHFFFAOYSA-N
MW314.35 g/mol
LogP2.40
Rot. Bonds3

About (1-pyridin-2-ylpiperidin-4-yl) N-(5-hydroxy-2-pyridinyl)carbamate

(1-pyridin-2-ylpiperidin-4-yl) N-(5-hydroxy-2-pyridinyl)carbamate (PubChem CID 142622775) has the molecular formula C16H18N4O3 and a molecular weight of 314.35 g/mol. Its IUPAC name is (1-pyridin-2-ylpiperidin-4-yl) N-(5-hydroxy-2-pyridinyl)carbamate.

Molecular Properties

Compound Name(1-pyridin-2-ylpiperidin-4-yl) N-(5-hydroxy-2-pyridinyl)carbamate
PubChem CID142622775
Molecular FormulaC16H18N4O3
Molecular Weight314.35 g/mol
Exact Mass314.14
IUPAC Name(1-pyridin-2-ylpiperidin-4-yl) N-(5-hydroxy-2-pyridinyl)carbamate
SMILESO=C(Nc1ccc(O)cn1)OC1CCN(c2ccccn2)CC1
InChIInChI=1S/C16H18N4O3/c21-12-4-5-14(18-11-12)19-16(22)23-13-6-9-20(10-7-13)15-3-1-2-8-17-15/h1-5,8,11,13,21H,6-7,9-10H2,(H,18,19,22)
InChIKeySCQIYRRYVMXCCI-UHFFFAOYSA-N
XLogP2.40
TPSA87.58 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.35
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

cyclohexyl N-pyridin-2-ylcarbamate
CID 127539206
[1-(4-methylphenyl)piperidin-4-yl] N-(5-methyl-2-pyridinyl)carbamate
CID 161060422
O-(1-pyridin-2-ylpiperidin-4-yl)hydroxylamine
CID 129267399
N-[5-(4-pyridin-2-ylpiperazin-1-yl)-2-pyridinyl]propanamide
CID 113029557
4-fluoro-N-[5-(4-pyridin-2-ylpiperazin-1-yl)-2-pyridinyl]benzamide
CID 113029575
1-phenyl-3-[5-(4-pyridin-2-ylpiperazin-1-yl)-2-pyridinyl]urea
CID 113029595
1-(1-pyridin-2-ylpiperidin-4-yl)ethanone
CID 63845661
1-(1-pyridin-2-ylpiperidin-4-yl)oxypyridin-2-one
CID 140566386
2-[4-(2-methoxyethoxy)piperidin-1-yl]pyridine
CID 133448541
1-(5-hydroxy-2-pyridinyl)piperidine-4-carboxylic acid
CID 67234813
iodomethane;[(3S)-1-pyridin-4-ylpyrrolidin-3-yl] N-[2-[(5-chloro-2-pyridinyl)carbamoyl]phenyl]carbamate
CID 159412496
2,2-difluoro-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide
CID 103514862

Frequently Asked Questions

What is the IUPAC name of (1-pyridin-2-ylpiperidin-4-yl) N-(5-hydroxy-2-pyridinyl)carbamate?
The IUPAC name of (1-pyridin-2-ylpiperidin-4-yl) N-(5-hydroxy-2-pyridinyl)carbamate (CID 142622775) is (1-pyridin-2-ylpiperidin-4-yl) N-(5-hydroxy-2-pyridinyl)carbamate.
What is the SMILES notation for (1-pyridin-2-ylpiperidin-4-yl) N-(5-hydroxy-2-pyridinyl)carbamate?
The canonical SMILES for (1-pyridin-2-ylpiperidin-4-yl) N-(5-hydroxy-2-pyridinyl)carbamate is O=C(Nc1ccc(O)cn1)OC1CCN(c2ccccn2)CC1.
What is the InChIKey of (1-pyridin-2-ylpiperidin-4-yl) N-(5-hydroxy-2-pyridinyl)carbamate?
The InChIKey is SCQIYRRYVMXCCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O3/c21-12-4-5-14(18-11-12)19-16(22)23-13-6-9-20(10-7-13)15-3-1-2-8-17-15/h1-5,8,11,13,21H,6-7,9-10H2,(H,18,19,22).
What are the key properties of (1-pyridin-2-ylpiperidin-4-yl) N-(5-hydroxy-2-pyridinyl)carbamate?
(1-pyridin-2-ylpiperidin-4-yl) N-(5-hydroxy-2-pyridinyl)carbamate has a molecular weight of 314.35 g/mol, XLogP of 2.40, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1-pyridin-2-ylpiperidin-4-yl) N-(5-hydroxy-2-pyridinyl)carbamate is sourced from PubChem (CID 142622775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).