N-cycloheptyl-3-pyrrolidin-1-ylpropanamide

C14H26N2O — CID 110688180

IUPACN-cycloheptyl-3-pyrrolidin-1-ylpropanamide
SMILESO=C(CCN1CCCC1)NC1CCCCCC1
InChIInChI=1S/C14H26N2O/c17-14(9-12-16-10-5-6-11-16)15-13-7-3-1-2-4-8-13/h13H,1-12H2,(H,15,17)
InChIKeyPESHGUYJCSAEFS-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.31
Rot. Bonds4

About N-cycloheptyl-3-pyrrolidin-1-ylpropanamide

N-cycloheptyl-3-pyrrolidin-1-ylpropanamide (PubChem CID 110688180) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is N-cycloheptyl-3-pyrrolidin-1-ylpropanamide.

Molecular Properties

Compound NameN-cycloheptyl-3-pyrrolidin-1-ylpropanamide
PubChem CID110688180
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC NameN-cycloheptyl-3-pyrrolidin-1-ylpropanamide
SMILESO=C(CCN1CCCC1)NC1CCCCCC1
InChIInChI=1S/C14H26N2O/c17-14(9-12-16-10-5-6-11-16)15-13-7-3-1-2-4-8-13/h13H,1-12H2,(H,15,17)
InChIKeyPESHGUYJCSAEFS-UHFFFAOYSA-N
XLogP2.31
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(azepan-1-yl)-N-cyclohexylpropanamide
CID 109014005
N-cyclohexyl-3-pyrrolidin-1-ylpropanamide
CID 71029146
N-cyclohexyl-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide
CID 60706788
N-cyclohexyl-3-piperazin-1-ylpropanamide
CID 28807752
N-cyclohexyl-3-(1,4-diazepan-1-yl)propanamide
CID 43162430
N-cyclohexyl-3-[3-(methylamino)piperidin-1-yl]propanamide
CID 62547743
N-(1-methylpiperidin-3-yl)-3-pyrrolidin-1-ylpropanamide
CID 121458775
3-[4-(1-aminoethyl)piperidin-1-yl]-N-cyclohexylpropanamide
CID 63596230
N-cyclopentyl-3-(4-sulfamoylpiperazin-1-yl)propanamide
CID 47358418
N-cyclohexyl-3-(4-piperidin-4-ylpiperazin-1-yl)propanamide
CID 67762492
3-[4-[2-(cyclohexylamino)-2-oxoethyl]piperazin-1-yl]propanoic acid
CID 43522437
N-cyclohexyl-3-[3-(1-hydroxyethyl)pyrrolidin-1-yl]propanamide
CID 112628386

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-3-pyrrolidin-1-ylpropanamide?
The IUPAC name of N-cycloheptyl-3-pyrrolidin-1-ylpropanamide (CID 110688180) is N-cycloheptyl-3-pyrrolidin-1-ylpropanamide.
What is the SMILES notation for N-cycloheptyl-3-pyrrolidin-1-ylpropanamide?
The canonical SMILES for N-cycloheptyl-3-pyrrolidin-1-ylpropanamide is O=C(CCN1CCCC1)NC1CCCCCC1.
What is the InChIKey of N-cycloheptyl-3-pyrrolidin-1-ylpropanamide?
The InChIKey is PESHGUYJCSAEFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c17-14(9-12-16-10-5-6-11-16)15-13-7-3-1-2-4-8-13/h13H,1-12H2,(H,15,17).
What are the key properties of N-cycloheptyl-3-pyrrolidin-1-ylpropanamide?
N-cycloheptyl-3-pyrrolidin-1-ylpropanamide has a molecular weight of 238.37 g/mol, XLogP of 2.31, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-3-pyrrolidin-1-ylpropanamide is sourced from PubChem (CID 110688180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).