1-[3-cyclopropyl-1-(ethylamino)-1-oxopropan-2-yl]cyclobutane-1-carboxamide

C13H22N2O2 — CID 71050551

IUPAC1-[3-cyclopropyl-1-(ethylamino)-1-oxopropan-2-yl]cyclobutane-1-carboxamide
SMILESCCNC(=O)C(CC1CC1)C1(C(N)=O)CCC1
InChIInChI=1S/C13H22N2O2/c1-2-15-11(16)10(8-9-4-5-9)13(12(14)17)6-3-7-13/h9-10H,2-8H2,1H3,(H2,14,17)(H,15,16)
InChIKeyCHPYJVYCEKNTFC-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.19
Rot. Bonds6

About 1-[3-cyclopropyl-1-(ethylamino)-1-oxopropan-2-yl]cyclobutane-1-carboxamide

1-[3-cyclopropyl-1-(ethylamino)-1-oxopropan-2-yl]cyclobutane-1-carboxamide (PubChem CID 71050551) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 1-[3-cyclopropyl-1-(ethylamino)-1-oxopropan-2-yl]cyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-[3-cyclopropyl-1-(ethylamino)-1-oxopropan-2-yl]cyclobutane-1-carboxamide
PubChem CID71050551
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name1-[3-cyclopropyl-1-(ethylamino)-1-oxopropan-2-yl]cyclobutane-1-carboxamide
SMILESCCNC(=O)C(CC1CC1)C1(C(N)=O)CCC1
InChIInChI=1S/C13H22N2O2/c1-2-15-11(16)10(8-9-4-5-9)13(12(14)17)6-3-7-13/h9-10H,2-8H2,1H3,(H2,14,17)(H,15,16)
InChIKeyCHPYJVYCEKNTFC-UHFFFAOYSA-N
XLogP1.19
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[3-cyclopentyl-1-(ethylamino)-1-oxopropan-2-yl]cyclopropane-1-carboxamide
CID 71050663
1-[(2R)-1-(tert-butylamino)-3-cyclopropyl-1-oxopropan-2-yl]cyclopentane-1-carboxamide
CID 59033290
1-[1-(tert-butylamino)-3-cyclobutyl-1-oxopropan-2-yl]cyclobutane-1-carboxamide
CID 23555109
1-[1-(tert-butylamino)-3-cyclopentyl-1-oxopropan-2-yl]cyclobutane-1-carboxamide
CID 23555113
1-[(2R)-1-(tert-butylamino)-3-cyclopropyl-1-oxopropan-2-yl]cyclopropane-1-carboxamide
CID 59033328
1-[(2R)-1-(tert-butylamino)-3-cyclopentyl-1-oxopropan-2-yl]cyclohexane-1-carboxamide
CID 59033305
1-[1-(ethylamino)-3-methyl-1-oxobutan-2-yl]cyclopentane-1-carboxamide
CID 71026868
(2R)-2-amino-3-cyclopropyl-N-ethylpropanamide
CID 82668057
(2S,3R)-2-(2-cyclopropylethyl)-3-(cyclopropylmethyl)-N'-ethylbutanediamide
CID 71148603
(2S,3R)-3-(cyclobutylmethyl)-N'-ethyl-2-propylbutanediamide
CID 71148531
1-[1-(ethylamino)-3-methyl-1-oxobut-3-en-2-yl]cyclopropane-1-carboxamide
CID 89200903
2,2-dicyclohexyl-N-ethylacetamide
CID 71067645

Frequently Asked Questions

What is the IUPAC name of 1-[3-cyclopropyl-1-(ethylamino)-1-oxopropan-2-yl]cyclobutane-1-carboxamide?
The IUPAC name of 1-[3-cyclopropyl-1-(ethylamino)-1-oxopropan-2-yl]cyclobutane-1-carboxamide (CID 71050551) is 1-[3-cyclopropyl-1-(ethylamino)-1-oxopropan-2-yl]cyclobutane-1-carboxamide.
What is the SMILES notation for 1-[3-cyclopropyl-1-(ethylamino)-1-oxopropan-2-yl]cyclobutane-1-carboxamide?
The canonical SMILES for 1-[3-cyclopropyl-1-(ethylamino)-1-oxopropan-2-yl]cyclobutane-1-carboxamide is CCNC(=O)C(CC1CC1)C1(C(N)=O)CCC1.
What is the InChIKey of 1-[3-cyclopropyl-1-(ethylamino)-1-oxopropan-2-yl]cyclobutane-1-carboxamide?
The InChIKey is CHPYJVYCEKNTFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-2-15-11(16)10(8-9-4-5-9)13(12(14)17)6-3-7-13/h9-10H,2-8H2,1H3,(H2,14,17)(H,15,16).
What are the key properties of 1-[3-cyclopropyl-1-(ethylamino)-1-oxopropan-2-yl]cyclobutane-1-carboxamide?
1-[3-cyclopropyl-1-(ethylamino)-1-oxopropan-2-yl]cyclobutane-1-carboxamide has a molecular weight of 238.33 g/mol, XLogP of 1.19, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-cyclopropyl-1-(ethylamino)-1-oxopropan-2-yl]cyclobutane-1-carboxamide is sourced from PubChem (CID 71050551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).