2-[2-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethylamino]pyridine-3-carboxamide

C14H22N4O2 — CID 164642989

IUPAC2-[2-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethylamino]pyridine-3-carboxamide
SMILESNC(=O)c1cccnc1NCCN1CCCC[C@@H]1CO
InChIInChI=1S/C14H22N4O2/c15-13(20)12-5-3-6-16-14(12)17-7-9-18-8-2-1-4-11(18)10-19/h3,5-6,11,19H,1-2,4,7-10H2,(H2,15,20)(H,16,17)/t11-/m1/s1
InChIKeyAOMYBUSRCBPEJX-LLVKDONJSA-N
MW278.36 g/mol
LogP0.44
Rot. Bonds6

About 2-[2-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethylamino]pyridine-3-carboxamide

2-[2-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethylamino]pyridine-3-carboxamide (PubChem CID 164642989) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-[2-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethylamino]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-[2-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethylamino]pyridine-3-carboxamide
PubChem CID164642989
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name2-[2-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethylamino]pyridine-3-carboxamide
SMILESNC(=O)c1cccnc1NCCN1CCCC[C@@H]1CO
InChIInChI=1S/C14H22N4O2/c15-13(20)12-5-3-6-16-14(12)17-7-9-18-8-2-1-4-11(18)10-19/h3,5-6,11,19H,1-2,4,7-10H2,(H2,15,20)(H,16,17)/t11-/m1/s1
InChIKeyAOMYBUSRCBPEJX-LLVKDONJSA-N
XLogP0.44
TPSA91.48 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethylamino]pyridine-3-carboxamide?
The IUPAC name of 2-[2-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethylamino]pyridine-3-carboxamide (CID 164642989) is 2-[2-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethylamino]pyridine-3-carboxamide.
What is the SMILES notation for 2-[2-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethylamino]pyridine-3-carboxamide?
The canonical SMILES for 2-[2-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethylamino]pyridine-3-carboxamide is NC(=O)c1cccnc1NCCN1CCCC[C@@H]1CO.
What is the InChIKey of 2-[2-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethylamino]pyridine-3-carboxamide?
The InChIKey is AOMYBUSRCBPEJX-LLVKDONJSA-N. The full InChI is InChI=1S/C14H22N4O2/c15-13(20)12-5-3-6-16-14(12)17-7-9-18-8-2-1-4-11(18)10-19/h3,5-6,11,19H,1-2,4,7-10H2,(H2,15,20)(H,16,17)/t11-/m1/s1.
What are the key properties of 2-[2-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethylamino]pyridine-3-carboxamide?
2-[2-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethylamino]pyridine-3-carboxamide has a molecular weight of 278.36 g/mol, XLogP of 0.44, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethylamino]pyridine-3-carboxamide is sourced from PubChem (CID 164642989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).