(2R)-N-[(E)-1-(methylamino)prop-1-en-2-yl]piperidine-2-carboxamide

C10H19N3O — CID 156560931

IUPAC(2R)-N-[(E)-1-(methylamino)prop-1-en-2-yl]piperidine-2-carboxamide
SMILESCN/C=C(\C)NC(=O)[C@H]1CCCCN1
InChIInChI=1S/C10H19N3O/c1-8(7-11-2)13-10(14)9-5-3-4-6-12-9/h7,9,11-12H,3-6H2,1-2H3,(H,13,14)/b8-7+/t9-/m1/s1
InChIKeyPVFWKWPXUYEUFG-FCZSHJHJSA-N
MW197.28 g/mol
LogP0.33
Rot. Bonds3

About (2R)-N-[(E)-1-(methylamino)prop-1-en-2-yl]piperidine-2-carboxamide

(2R)-N-[(E)-1-(methylamino)prop-1-en-2-yl]piperidine-2-carboxamide (PubChem CID 156560931) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is (2R)-N-[(E)-1-(methylamino)prop-1-en-2-yl]piperidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[(E)-1-(methylamino)prop-1-en-2-yl]piperidine-2-carboxamide
PubChem CID156560931
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name(2R)-N-[(E)-1-(methylamino)prop-1-en-2-yl]piperidine-2-carboxamide
SMILESCN/C=C(\C)NC(=O)[C@H]1CCCCN1
InChIInChI=1S/C10H19N3O/c1-8(7-11-2)13-10(14)9-5-3-4-6-12-9/h7,9,11-12H,3-6H2,1-2H3,(H,13,14)/b8-7+/t9-/m1/s1
InChIKeyPVFWKWPXUYEUFG-FCZSHJHJSA-N
XLogP0.33
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(E)-1-(methylamino)prop-1-en-2-yl]piperidine-2-carboxamide?
The IUPAC name of (2R)-N-[(E)-1-(methylamino)prop-1-en-2-yl]piperidine-2-carboxamide (CID 156560931) is (2R)-N-[(E)-1-(methylamino)prop-1-en-2-yl]piperidine-2-carboxamide.
What is the SMILES notation for (2R)-N-[(E)-1-(methylamino)prop-1-en-2-yl]piperidine-2-carboxamide?
The canonical SMILES for (2R)-N-[(E)-1-(methylamino)prop-1-en-2-yl]piperidine-2-carboxamide is CN/C=C(\C)NC(=O)[C@H]1CCCCN1.
What is the InChIKey of (2R)-N-[(E)-1-(methylamino)prop-1-en-2-yl]piperidine-2-carboxamide?
The InChIKey is PVFWKWPXUYEUFG-FCZSHJHJSA-N. The full InChI is InChI=1S/C10H19N3O/c1-8(7-11-2)13-10(14)9-5-3-4-6-12-9/h7,9,11-12H,3-6H2,1-2H3,(H,13,14)/b8-7+/t9-/m1/s1.
What are the key properties of (2R)-N-[(E)-1-(methylamino)prop-1-en-2-yl]piperidine-2-carboxamide?
(2R)-N-[(E)-1-(methylamino)prop-1-en-2-yl]piperidine-2-carboxamide has a molecular weight of 197.28 g/mol, XLogP of 0.33, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(E)-1-(methylamino)prop-1-en-2-yl]piperidine-2-carboxamide is sourced from PubChem (CID 156560931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).