4-methyl-N-propylpiperazine-1-carboxamide

C9H19N3O — CID 6461326

IUPAC4-methyl-N-propylpiperazine-1-carboxamide
SMILESCCCNC(=O)N1CCN(C)CC1
InChIInChI=1S/C9H19N3O/c1-3-4-10-9(13)12-7-5-11(2)6-8-12/h3-8H2,1-2H3,(H,10,13)
InChIKeyFMYNCYDORCRGJY-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.35
Rot. Bonds2

About 4-methyl-N-propylpiperazine-1-carboxamide

4-methyl-N-propylpiperazine-1-carboxamide (PubChem CID 6461326) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is 4-methyl-N-propylpiperazine-1-carboxamide.

Molecular Properties

Compound Name4-methyl-N-propylpiperazine-1-carboxamide
PubChem CID6461326
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC Name4-methyl-N-propylpiperazine-1-carboxamide
SMILESCCCNC(=O)N1CCN(C)CC1
InChIInChI=1S/C9H19N3O/c1-3-4-10-9(13)12-7-5-11(2)6-8-12/h3-8H2,1-2H3,(H,10,13)
InChIKeyFMYNCYDORCRGJY-UHFFFAOYSA-N
XLogP0.35
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-propylpiperazine-1-carboxamide?
The IUPAC name of 4-methyl-N-propylpiperazine-1-carboxamide (CID 6461326) is 4-methyl-N-propylpiperazine-1-carboxamide.
What is the SMILES notation for 4-methyl-N-propylpiperazine-1-carboxamide?
The canonical SMILES for 4-methyl-N-propylpiperazine-1-carboxamide is CCCNC(=O)N1CCN(C)CC1.
What is the InChIKey of 4-methyl-N-propylpiperazine-1-carboxamide?
The InChIKey is FMYNCYDORCRGJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O/c1-3-4-10-9(13)12-7-5-11(2)6-8-12/h3-8H2,1-2H3,(H,10,13).
What are the key properties of 4-methyl-N-propylpiperazine-1-carboxamide?
4-methyl-N-propylpiperazine-1-carboxamide has a molecular weight of 185.27 g/mol, XLogP of 0.35, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-propylpiperazine-1-carboxamide is sourced from PubChem (CID 6461326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).