2-[(2R)-2-methylpiperazin-1-yl]-N-propylacetamide

C10H21N3O — CID 82713907

IUPAC2-[(2R)-2-methylpiperazin-1-yl]-N-propylacetamide
SMILESCCCNC(=O)CN1CCNC[C@H]1C
InChIInChI=1S/C10H21N3O/c1-3-4-12-10(14)8-13-6-5-11-7-9(13)2/h9,11H,3-8H2,1-2H3,(H,12,14)/t9-/m1/s1
InChIKeyOVCXUZCNPNBGKP-SECBINFHSA-N
MW199.30 g/mol
LogP-0.19
Rot. Bonds4

About 2-[(2R)-2-methylpiperazin-1-yl]-N-propylacetamide

2-[(2R)-2-methylpiperazin-1-yl]-N-propylacetamide (PubChem CID 82713907) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 2-[(2R)-2-methylpiperazin-1-yl]-N-propylacetamide.

Molecular Properties

Compound Name2-[(2R)-2-methylpiperazin-1-yl]-N-propylacetamide
PubChem CID82713907
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name2-[(2R)-2-methylpiperazin-1-yl]-N-propylacetamide
SMILESCCCNC(=O)CN1CCNC[C@H]1C
InChIInChI=1S/C10H21N3O/c1-3-4-12-10(14)8-13-6-5-11-7-9(13)2/h9,11H,3-8H2,1-2H3,(H,12,14)/t9-/m1/s1
InChIKeyOVCXUZCNPNBGKP-SECBINFHSA-N
XLogP-0.19
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-2-methylpiperazin-1-yl]-N-propylacetamide?
The IUPAC name of 2-[(2R)-2-methylpiperazin-1-yl]-N-propylacetamide (CID 82713907) is 2-[(2R)-2-methylpiperazin-1-yl]-N-propylacetamide.
What is the SMILES notation for 2-[(2R)-2-methylpiperazin-1-yl]-N-propylacetamide?
The canonical SMILES for 2-[(2R)-2-methylpiperazin-1-yl]-N-propylacetamide is CCCNC(=O)CN1CCNC[C@H]1C.
What is the InChIKey of 2-[(2R)-2-methylpiperazin-1-yl]-N-propylacetamide?
The InChIKey is OVCXUZCNPNBGKP-SECBINFHSA-N. The full InChI is InChI=1S/C10H21N3O/c1-3-4-12-10(14)8-13-6-5-11-7-9(13)2/h9,11H,3-8H2,1-2H3,(H,12,14)/t9-/m1/s1.
What are the key properties of 2-[(2R)-2-methylpiperazin-1-yl]-N-propylacetamide?
2-[(2R)-2-methylpiperazin-1-yl]-N-propylacetamide has a molecular weight of 199.30 g/mol, XLogP of -0.19, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-2-methylpiperazin-1-yl]-N-propylacetamide is sourced from PubChem (CID 82713907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).