N-cyclohexyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide

C15H29N3O2 — CID 60706788

IUPACN-cyclohexyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide
SMILESO=C(CCN1CCN(CCO)CC1)NC1CCCCC1
InChIInChI=1S/C15H29N3O2/c19-13-12-18-10-8-17(9-11-18)7-6-15(20)16-14-4-2-1-3-5-14/h14,19H,1-13H2,(H,16,20)
InChIKeySFPAZHYXLOVVRK-UHFFFAOYSA-N
MW283.42 g/mol
LogP0.44
Rot. Bonds6

About N-cyclohexyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide

N-cyclohexyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide (PubChem CID 60706788) has the molecular formula C15H29N3O2 and a molecular weight of 283.42 g/mol. Its IUPAC name is N-cyclohexyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide.

Molecular Properties

Compound NameN-cyclohexyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide
PubChem CID60706788
Molecular FormulaC15H29N3O2
Molecular Weight283.42 g/mol
Exact Mass283.23
IUPAC NameN-cyclohexyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide
SMILESO=C(CCN1CCN(CCO)CC1)NC1CCCCC1
InChIInChI=1S/C15H29N3O2/c19-13-12-18-10-8-17(9-11-18)7-6-15(20)16-14-4-2-1-3-5-14/h14,19H,1-13H2,(H,16,20)
InChIKeySFPAZHYXLOVVRK-UHFFFAOYSA-N
XLogP0.44
TPSA55.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide?
The IUPAC name of N-cyclohexyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide (CID 60706788) is N-cyclohexyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide.
What is the SMILES notation for N-cyclohexyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide?
The canonical SMILES for N-cyclohexyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide is O=C(CCN1CCN(CCO)CC1)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide?
The InChIKey is SFPAZHYXLOVVRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O2/c19-13-12-18-10-8-17(9-11-18)7-6-15(20)16-14-4-2-1-3-5-14/h14,19H,1-13H2,(H,16,20).
What are the key properties of N-cyclohexyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide?
N-cyclohexyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide has a molecular weight of 283.42 g/mol, XLogP of 0.44, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide is sourced from PubChem (CID 60706788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).