cyclopentyl N-[3-(cyclopropylamino)-3-oxopropyl]carbamate

C12H20N2O3 — CID 112738846

IUPACcyclopentyl N-[3-(cyclopropylamino)-3-oxopropyl]carbamate
SMILESO=C(CCNC(=O)OC1CCCC1)NC1CC1
InChIInChI=1S/C12H20N2O3/c15-11(14-9-5-6-9)7-8-13-12(16)17-10-3-1-2-4-10/h9-10H,1-8H2,(H,13,16)(H,14,15)
InChIKeyLPOHXGFWOCUFTA-UHFFFAOYSA-N
MW240.30 g/mol
LogP1.32
Rot. Bonds5

About cyclopentyl N-[3-(cyclopropylamino)-3-oxopropyl]carbamate

cyclopentyl N-[3-(cyclopropylamino)-3-oxopropyl]carbamate (PubChem CID 112738846) has the molecular formula C12H20N2O3 and a molecular weight of 240.30 g/mol. Its IUPAC name is cyclopentyl N-[3-(cyclopropylamino)-3-oxopropyl]carbamate.

Molecular Properties

Compound Namecyclopentyl N-[3-(cyclopropylamino)-3-oxopropyl]carbamate
PubChem CID112738846
Molecular FormulaC12H20N2O3
Molecular Weight240.30 g/mol
Exact Mass240.15
IUPAC Namecyclopentyl N-[3-(cyclopropylamino)-3-oxopropyl]carbamate
SMILESO=C(CCNC(=O)OC1CCCC1)NC1CC1
InChIInChI=1S/C12H20N2O3/c15-11(14-9-5-6-9)7-8-13-12(16)17-10-3-1-2-4-10/h9-10H,1-8H2,(H,13,16)(H,14,15)
InChIKeyLPOHXGFWOCUFTA-UHFFFAOYSA-N
XLogP1.32
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

cyclopentyl N-[4-(cyclopropylamino)-4-oxobutyl]carbamate
CID 112738847
tert-butyl N-[3-(cyclopropylamino)-3-oxopropyl]carbamate
CID 24688554
3-(cyclobutylamino)-N-cyclopropylpropanamide
CID 62627198
3-(carbamoylamino)-N-cyclohexylpropanamide
CID 47116358
N-cyclopropyl-3-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide
CID 79394765
phenyl N-[3-(cyclohexylamino)-3-oxopropyl]carbamate
CID 1131242
N,N'-dicyclopropylbutanediamide
CID 5225156
cyclododecyl N-cyclobutylcarbamate
CID 135210614
cyclopentyl N-ethylcarbamate
CID 54482890
N-[3-(cyclopropylamino)-3-oxopropyl]pyrrolidine-1-carboxamide
CID 116656665
N,N'-dicyclopropyldecanediamide
CID 4668836
cyclohexyl N-ethylcarbamate
CID 22978796

Frequently Asked Questions

What is the IUPAC name of cyclopentyl N-[3-(cyclopropylamino)-3-oxopropyl]carbamate?
The IUPAC name of cyclopentyl N-[3-(cyclopropylamino)-3-oxopropyl]carbamate (CID 112738846) is cyclopentyl N-[3-(cyclopropylamino)-3-oxopropyl]carbamate.
What is the SMILES notation for cyclopentyl N-[3-(cyclopropylamino)-3-oxopropyl]carbamate?
The canonical SMILES for cyclopentyl N-[3-(cyclopropylamino)-3-oxopropyl]carbamate is O=C(CCNC(=O)OC1CCCC1)NC1CC1.
What is the InChIKey of cyclopentyl N-[3-(cyclopropylamino)-3-oxopropyl]carbamate?
The InChIKey is LPOHXGFWOCUFTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O3/c15-11(14-9-5-6-9)7-8-13-12(16)17-10-3-1-2-4-10/h9-10H,1-8H2,(H,13,16)(H,14,15).
What are the key properties of cyclopentyl N-[3-(cyclopropylamino)-3-oxopropyl]carbamate?
cyclopentyl N-[3-(cyclopropylamino)-3-oxopropyl]carbamate has a molecular weight of 240.30 g/mol, XLogP of 1.32, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl N-[3-(cyclopropylamino)-3-oxopropyl]carbamate is sourced from PubChem (CID 112738846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).