N,N-dimethyl-4-prop-1-en-2-ylpiperazine-1-carboxamide

C10H19N3O — CID 177186916

IUPACN,N-dimethyl-4-prop-1-en-2-ylpiperazine-1-carboxamide
SMILESC=C(C)N1CCN(C(=O)N(C)C)CC1
InChIInChI=1S/C10H19N3O/c1-9(2)12-5-7-13(8-6-12)10(14)11(3)4/h1,5-8H2,2-4H3
InChIKeyJJTRZDFOUOCIHW-UHFFFAOYSA-N
MW197.28 g/mol
LogP0.82
Rot. Bonds1

About N,N-dimethyl-4-prop-1-en-2-ylpiperazine-1-carboxamide

N,N-dimethyl-4-prop-1-en-2-ylpiperazine-1-carboxamide (PubChem CID 177186916) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is N,N-dimethyl-4-prop-1-en-2-ylpiperazine-1-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-4-prop-1-en-2-ylpiperazine-1-carboxamide
PubChem CID177186916
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC NameN,N-dimethyl-4-prop-1-en-2-ylpiperazine-1-carboxamide
SMILESC=C(C)N1CCN(C(=O)N(C)C)CC1
InChIInChI=1S/C10H19N3O/c1-9(2)12-5-7-13(8-6-12)10(14)11(3)4/h1,5-8H2,2-4H3
InChIKeyJJTRZDFOUOCIHW-UHFFFAOYSA-N
XLogP0.82
TPSA26.79 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-prop-1-en-2-ylpiperazine-1-carboxamide?
The IUPAC name of N,N-dimethyl-4-prop-1-en-2-ylpiperazine-1-carboxamide (CID 177186916) is N,N-dimethyl-4-prop-1-en-2-ylpiperazine-1-carboxamide.
What is the SMILES notation for N,N-dimethyl-4-prop-1-en-2-ylpiperazine-1-carboxamide?
The canonical SMILES for N,N-dimethyl-4-prop-1-en-2-ylpiperazine-1-carboxamide is C=C(C)N1CCN(C(=O)N(C)C)CC1.
What is the InChIKey of N,N-dimethyl-4-prop-1-en-2-ylpiperazine-1-carboxamide?
The InChIKey is JJTRZDFOUOCIHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-9(2)12-5-7-13(8-6-12)10(14)11(3)4/h1,5-8H2,2-4H3.
What are the key properties of N,N-dimethyl-4-prop-1-en-2-ylpiperazine-1-carboxamide?
N,N-dimethyl-4-prop-1-en-2-ylpiperazine-1-carboxamide has a molecular weight of 197.28 g/mol, XLogP of 0.82, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-prop-1-en-2-ylpiperazine-1-carboxamide is sourced from PubChem (CID 177186916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).