N-cyclohexyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propanamide

C15H28N2O2 — CID 112628386

IUPACN-cyclohexyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propanamide
SMILESCC(O)C1CCN(CCC(=O)NC2CCCCC2)C1
InChIInChI=1S/C15H28N2O2/c1-12(18)13-7-9-17(11-13)10-8-15(19)16-14-5-3-2-4-6-14/h12-14,18H,2-11H2,1H3,(H,16,19)
InChIKeyPNIMUEZMOVOUAN-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.53
Rot. Bonds5

About N-cyclohexyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propanamide

N-cyclohexyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propanamide (PubChem CID 112628386) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-cyclohexyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propanamide.

Molecular Properties

Compound NameN-cyclohexyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propanamide
PubChem CID112628386
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC NameN-cyclohexyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propanamide
SMILESCC(O)C1CCN(CCC(=O)NC2CCCCC2)C1
InChIInChI=1S/C15H28N2O2/c1-12(18)13-7-9-17(11-13)10-8-15(19)16-14-5-3-2-4-6-14/h12-14,18H,2-11H2,1H3,(H,16,19)
InChIKeyPNIMUEZMOVOUAN-UHFFFAOYSA-N
XLogP1.53
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cycloheptyl-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide
CID 112628204
3-[4-(1-aminoethyl)piperidin-1-yl]-N-cyclohexylpropanamide
CID 63596230
N-cyclohexyl-3-[3-(methylamino)piperidin-1-yl]propanamide
CID 62547743
N-cycloheptyl-3-pyrrolidin-1-ylpropanamide
CID 110688180
3-(azepan-1-yl)-N-cyclohexylpropanamide
CID 109014005
N-cyclohexyl-3-pyrrolidin-1-ylpropanamide
CID 71029146
N-(1-ethylpiperidin-4-yl)-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide
CID 110019949
1-[1-(2-piperidin-1-ylethyl)pyrrolidin-3-yl]ethanol
CID 112628491
N-cyclopropyl-3-[4-[1-(methylamino)ethyl]piperidin-1-yl]propanamide
CID 63854650
N-cyclohexyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide
CID 60706788
(2R)-5-(cyclohexylamino)-2-methyl-5-oxopentanoic acid
CID 2200165
N-cyclohexyl-3-piperazin-1-ylpropanamide
CID 28807752

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propanamide?
The IUPAC name of N-cyclohexyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propanamide (CID 112628386) is N-cyclohexyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propanamide.
What is the SMILES notation for N-cyclohexyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propanamide?
The canonical SMILES for N-cyclohexyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propanamide is CC(O)C1CCN(CCC(=O)NC2CCCCC2)C1.
What is the InChIKey of N-cyclohexyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propanamide?
The InChIKey is PNIMUEZMOVOUAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-12(18)13-7-9-17(11-13)10-8-15(19)16-14-5-3-2-4-6-14/h12-14,18H,2-11H2,1H3,(H,16,19).
What are the key properties of N-cyclohexyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propanamide?
N-cyclohexyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propanamide has a molecular weight of 268.40 g/mol, XLogP of 1.53, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propanamide is sourced from PubChem (CID 112628386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).