5-[ethyl(propyl)amino]pentan-2-one

C10H21NO — CID 43792941

IUPAC5-[ethyl(propyl)amino]pentan-2-one
SMILESCCCN(CC)CCCC(C)=O
InChIInChI=1S/C10H21NO/c1-4-8-11(5-2)9-6-7-10(3)12/h4-9H2,1-3H3
InChIKeyMNNWSRKEGIVHAO-UHFFFAOYSA-N
MW171.28 g/mol
LogP2.09
Rot. Bonds7

About 5-[ethyl(propyl)amino]pentan-2-one

5-[ethyl(propyl)amino]pentan-2-one (PubChem CID 43792941) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 5-[ethyl(propyl)amino]pentan-2-one.

Molecular Properties

Compound Name5-[ethyl(propyl)amino]pentan-2-one
PubChem CID43792941
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name5-[ethyl(propyl)amino]pentan-2-one
SMILESCCCN(CC)CCCC(C)=O
InChIInChI=1S/C10H21NO/c1-4-8-11(5-2)9-6-7-10(3)12/h4-9H2,1-3H3
InChIKeyMNNWSRKEGIVHAO-UHFFFAOYSA-N
XLogP2.09
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-[ethyl(propyl)amino]hexan-2-one
CID 43792940
4-[ethyl(propyl)amino]butanoyl chloride
CID 143367030
7-[ethyl(7-hydroxyheptyl)amino]heptan-2-one
CID 171562657
4-[butyl(ethyl)amino]butanoic acid
CID 20991778
4-[ethyl(pentyl)amino]butanamide
CID 57048694
4-[ethyl(propyl)amino]-1-phenylbutan-1-one
CID 43792935
5-[benzyl(ethyl)amino]pentan-2-one
CID 62050785
4-[2-carboxyethyl(ethyl)amino]butanoic acid
CID 82330570
ethane;N-ethyl-N-(4-oxopentyl)propanamide
CID 143803136
N-ethyl-N-propylbutan-1-amine;pentane
CID 143329949
4-[ethyl(propyl)amino]-1-(4-fluorophenyl)butan-1-one
CID 43792937
ethane;N-ethyl-N-propylpropan-1-amine;hexane
CID 167521099

Frequently Asked Questions

What is the IUPAC name of 5-[ethyl(propyl)amino]pentan-2-one?
The IUPAC name of 5-[ethyl(propyl)amino]pentan-2-one (CID 43792941) is 5-[ethyl(propyl)amino]pentan-2-one.
What is the SMILES notation for 5-[ethyl(propyl)amino]pentan-2-one?
The canonical SMILES for 5-[ethyl(propyl)amino]pentan-2-one is CCCN(CC)CCCC(C)=O.
What is the InChIKey of 5-[ethyl(propyl)amino]pentan-2-one?
The InChIKey is MNNWSRKEGIVHAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-4-8-11(5-2)9-6-7-10(3)12/h4-9H2,1-3H3.
What are the key properties of 5-[ethyl(propyl)amino]pentan-2-one?
5-[ethyl(propyl)amino]pentan-2-one has a molecular weight of 171.28 g/mol, XLogP of 2.09, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[ethyl(propyl)amino]pentan-2-one is sourced from PubChem (CID 43792941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).