4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide

C14H25N3O2 — CID 110364786

IUPAC4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide
SMILESCCCNC(=O)N1CCN(C(=O)C2CCCC2)CC1
InChIInChI=1S/C14H25N3O2/c1-2-7-15-14(19)17-10-8-16(9-11-17)13(18)12-5-3-4-6-12/h12H,2-11H2,1H3,(H,15,19)
InChIKeyPRHWKWFYAKBCNX-UHFFFAOYSA-N
MW267.37 g/mol
LogP1.44
Rot. Bonds3

About 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide

4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide (PubChem CID 110364786) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide.

Molecular Properties

Compound Name4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide
PubChem CID110364786
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC Name4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide
SMILESCCCNC(=O)N1CCN(C(=O)C2CCCC2)CC1
InChIInChI=1S/C14H25N3O2/c1-2-7-15-14(19)17-10-8-16(9-11-17)13(18)12-5-3-4-6-12/h12H,2-11H2,1H3,(H,15,19)
InChIKeyPRHWKWFYAKBCNX-UHFFFAOYSA-N
XLogP1.44
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide?
The IUPAC name of 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide (CID 110364786) is 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide.
What is the SMILES notation for 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide?
The canonical SMILES for 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide is CCCNC(=O)N1CCN(C(=O)C2CCCC2)CC1.
What is the InChIKey of 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide?
The InChIKey is PRHWKWFYAKBCNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-2-7-15-14(19)17-10-8-16(9-11-17)13(18)12-5-3-4-6-12/h12H,2-11H2,1H3,(H,15,19).
What are the key properties of 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide?
4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide has a molecular weight of 267.37 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopentanecarbonyl)-N-propylpiperazine-1-carboxamide is sourced from PubChem (CID 110364786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).