N-[1-[4-(2-hydroxycyclopentyl)piperazine-1-carbonyl]cyclohexyl]acetamide

C18H31N3O3 — CID 75462672

IUPACN-[1-[4-(2-hydroxycyclopentyl)piperazine-1-carbonyl]cyclohexyl]acetamide
SMILESCC(=O)NC1(C(=O)N2CCN(C3CCCC3O)CC2)CCCCC1
InChIInChI=1S/C18H31N3O3/c1-14(22)19-18(8-3-2-4-9-18)17(24)21-12-10-20(11-13-21)15-6-5-7-16(15)23/h15-16,23H,2-13H2,1H3,(H,19,22)
InChIKeyZHFKYVCLKONXGD-UHFFFAOYSA-N
MW337.46 g/mol
LogP0.88
Rot. Bonds3

About N-[1-[4-(2-hydroxycyclopentyl)piperazine-1-carbonyl]cyclohexyl]acetamide

N-[1-[4-(2-hydroxycyclopentyl)piperazine-1-carbonyl]cyclohexyl]acetamide (PubChem CID 75462672) has the molecular formula C18H31N3O3 and a molecular weight of 337.46 g/mol. Its IUPAC name is N-[1-[4-(2-hydroxycyclopentyl)piperazine-1-carbonyl]cyclohexyl]acetamide.

Molecular Properties

Compound NameN-[1-[4-(2-hydroxycyclopentyl)piperazine-1-carbonyl]cyclohexyl]acetamide
PubChem CID75462672
Molecular FormulaC18H31N3O3
Molecular Weight337.46 g/mol
Exact Mass337.24
IUPAC NameN-[1-[4-(2-hydroxycyclopentyl)piperazine-1-carbonyl]cyclohexyl]acetamide
SMILESCC(=O)NC1(C(=O)N2CCN(C3CCCC3O)CC2)CCCCC1
InChIInChI=1S/C18H31N3O3/c1-14(22)19-18(8-3-2-4-9-18)17(24)21-12-10-20(11-13-21)15-6-5-7-16(15)23/h15-16,23H,2-13H2,1H3,(H,19,22)
InChIKeyZHFKYVCLKONXGD-UHFFFAOYSA-N
XLogP0.88
TPSA72.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.46
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-[4-(2-hydroxycyclopentyl)piperazine-1-carbonyl]cyclohexyl]acetamide?
The IUPAC name of N-[1-[4-(2-hydroxycyclopentyl)piperazine-1-carbonyl]cyclohexyl]acetamide (CID 75462672) is N-[1-[4-(2-hydroxycyclopentyl)piperazine-1-carbonyl]cyclohexyl]acetamide.
What is the SMILES notation for N-[1-[4-(2-hydroxycyclopentyl)piperazine-1-carbonyl]cyclohexyl]acetamide?
The canonical SMILES for N-[1-[4-(2-hydroxycyclopentyl)piperazine-1-carbonyl]cyclohexyl]acetamide is CC(=O)NC1(C(=O)N2CCN(C3CCCC3O)CC2)CCCCC1.
What is the InChIKey of N-[1-[4-(2-hydroxycyclopentyl)piperazine-1-carbonyl]cyclohexyl]acetamide?
The InChIKey is ZHFKYVCLKONXGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31N3O3/c1-14(22)19-18(8-3-2-4-9-18)17(24)21-12-10-20(11-13-21)15-6-5-7-16(15)23/h15-16,23H,2-13H2,1H3,(H,19,22).
What are the key properties of N-[1-[4-(2-hydroxycyclopentyl)piperazine-1-carbonyl]cyclohexyl]acetamide?
N-[1-[4-(2-hydroxycyclopentyl)piperazine-1-carbonyl]cyclohexyl]acetamide has a molecular weight of 337.46 g/mol, XLogP of 0.88, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[4-(2-hydroxycyclopentyl)piperazine-1-carbonyl]cyclohexyl]acetamide is sourced from PubChem (CID 75462672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).