N-[6-(dimethylamino)-3-pyridinyl]-2-(hydroxymethyl)-3-methylpiperidine-1-carboxamide

C15H24N4O2 — CID 71907067

IUPACN-[6-(dimethylamino)-3-pyridinyl]-2-(hydroxymethyl)-3-methylpiperidine-1-carboxamide
SMILESCC1CCCN(C(=O)Nc2ccc(N(C)C)nc2)C1CO
InChIInChI=1S/C15H24N4O2/c1-11-5-4-8-19(13(11)10-20)15(21)17-12-6-7-14(16-9-12)18(2)3/h6-7,9,11,13,20H,4-5,8,10H2,1-3H3,(H,17,21)
InChIKeyLGRLZMXECKVDRV-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.77
Rot. Bonds3

About N-[6-(dimethylamino)-3-pyridinyl]-2-(hydroxymethyl)-3-methylpiperidine-1-carboxamide

N-[6-(dimethylamino)-3-pyridinyl]-2-(hydroxymethyl)-3-methylpiperidine-1-carboxamide (PubChem CID 71907067) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-[6-(dimethylamino)-3-pyridinyl]-2-(hydroxymethyl)-3-methylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-[6-(dimethylamino)-3-pyridinyl]-2-(hydroxymethyl)-3-methylpiperidine-1-carboxamide
PubChem CID71907067
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC NameN-[6-(dimethylamino)-3-pyridinyl]-2-(hydroxymethyl)-3-methylpiperidine-1-carboxamide
SMILESCC1CCCN(C(=O)Nc2ccc(N(C)C)nc2)C1CO
InChIInChI=1S/C15H24N4O2/c1-11-5-4-8-19(13(11)10-20)15(21)17-12-6-7-14(16-9-12)18(2)3/h6-7,9,11,13,20H,4-5,8,10H2,1-3H3,(H,17,21)
InChIKeyLGRLZMXECKVDRV-UHFFFAOYSA-N
XLogP1.77
TPSA68.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[6-(dimethylamino)-3-pyridinyl]-2-(hydroxymethyl)-3-methylpiperidine-1-carboxamide?
The IUPAC name of N-[6-(dimethylamino)-3-pyridinyl]-2-(hydroxymethyl)-3-methylpiperidine-1-carboxamide (CID 71907067) is N-[6-(dimethylamino)-3-pyridinyl]-2-(hydroxymethyl)-3-methylpiperidine-1-carboxamide.
What is the SMILES notation for N-[6-(dimethylamino)-3-pyridinyl]-2-(hydroxymethyl)-3-methylpiperidine-1-carboxamide?
The canonical SMILES for N-[6-(dimethylamino)-3-pyridinyl]-2-(hydroxymethyl)-3-methylpiperidine-1-carboxamide is CC1CCCN(C(=O)Nc2ccc(N(C)C)nc2)C1CO.
What is the InChIKey of N-[6-(dimethylamino)-3-pyridinyl]-2-(hydroxymethyl)-3-methylpiperidine-1-carboxamide?
The InChIKey is LGRLZMXECKVDRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-11-5-4-8-19(13(11)10-20)15(21)17-12-6-7-14(16-9-12)18(2)3/h6-7,9,11,13,20H,4-5,8,10H2,1-3H3,(H,17,21).
What are the key properties of N-[6-(dimethylamino)-3-pyridinyl]-2-(hydroxymethyl)-3-methylpiperidine-1-carboxamide?
N-[6-(dimethylamino)-3-pyridinyl]-2-(hydroxymethyl)-3-methylpiperidine-1-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 1.77, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(dimethylamino)-3-pyridinyl]-2-(hydroxymethyl)-3-methylpiperidine-1-carboxamide is sourced from PubChem (CID 71907067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).