N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclopentanamine

C15H25N5 — CID 60849987

IUPACN-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclopentanamine
SMILESc1cnc(N2CCN(CCNC3CCCC3)CC2)nc1
InChIInChI=1S/C15H25N5/c1-2-5-14(4-1)16-8-9-19-10-12-20(13-11-19)15-17-6-3-7-18-15/h3,6-7,14,16H,1-2,4-5,8-13H2
InChIKeyBNVKQNIGWSBXTJ-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.13
Rot. Bonds5

About N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclopentanamine

N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclopentanamine (PubChem CID 60849987) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclopentanamine.

Molecular Properties

Compound NameN-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclopentanamine
PubChem CID60849987
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC NameN-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclopentanamine
SMILESc1cnc(N2CCN(CCNC3CCCC3)CC2)nc1
InChIInChI=1S/C15H25N5/c1-2-5-14(4-1)16-8-9-19-10-12-20(13-11-19)15-17-6-3-7-18-15/h3,6-7,14,16H,1-2,4-5,8-13H2
InChIKeyBNVKQNIGWSBXTJ-UHFFFAOYSA-N
XLogP1.13
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]pyrimidine
CID 102273193
2-methyl-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]propan-2-amine
CID 55070558
(3R)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]spiro[3.4]octan-3-amine
CID 99827051
N-[2-(4-methylpiperazin-1-yl)ethyl]cyclopentanamine
CID 60701361
N-(2-pyrrolidin-1-ylethyl)cyclohexanamine
CID 43181622
1-cyclopentyl-N-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamine
CID 104744506
N-(cyclopentylcarbamoyl)-3-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide
CID 31698296
N-(2-thiomorpholin-4-ylethyl)cyclopentanamine
CID 60849284
N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexanamine
CID 60701363
N-propan-2-yl-3-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-amine
CID 60853273
N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]prop-2-yn-1-amine
CID 62575755
3-cyclopentyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]propanamide
CID 39539501

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclopentanamine?
The IUPAC name of N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclopentanamine (CID 60849987) is N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclopentanamine.
What is the SMILES notation for N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclopentanamine?
The canonical SMILES for N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclopentanamine is c1cnc(N2CCN(CCNC3CCCC3)CC2)nc1.
What is the InChIKey of N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclopentanamine?
The InChIKey is BNVKQNIGWSBXTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-2-5-14(4-1)16-8-9-19-10-12-20(13-11-19)15-17-6-3-7-18-15/h3,6-7,14,16H,1-2,4-5,8-13H2.
What are the key properties of N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclopentanamine?
N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclopentanamine has a molecular weight of 275.40 g/mol, XLogP of 1.13, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclopentanamine is sourced from PubChem (CID 60849987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).