4-[cyclopentyl(methyl)amino]pentan-2-one

C11H21NO — CID 64698717

IUPAC4-[cyclopentyl(methyl)amino]pentan-2-one
SMILESCC(=O)CC(C)N(C)C1CCCC1
InChIInChI=1S/C11H21NO/c1-9(8-10(2)13)12(3)11-6-4-5-7-11/h9,11H,4-8H2,1-3H3
InChIKeyLITBPBSHQOKGDY-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.23
Rot. Bonds4

About 4-[cyclopentyl(methyl)amino]pentan-2-one

4-[cyclopentyl(methyl)amino]pentan-2-one (PubChem CID 64698717) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 4-[cyclopentyl(methyl)amino]pentan-2-one.

Molecular Properties

Compound Name4-[cyclopentyl(methyl)amino]pentan-2-one
PubChem CID64698717
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name4-[cyclopentyl(methyl)amino]pentan-2-one
SMILESCC(=O)CC(C)N(C)C1CCCC1
InChIInChI=1S/C11H21NO/c1-9(8-10(2)13)12(3)11-6-4-5-7-11/h9,11H,4-8H2,1-3H3
InChIKeyLITBPBSHQOKGDY-UHFFFAOYSA-N
XLogP2.23
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-[cycloheptyl(methyl)amino]pentan-2-one
CID 64696664
4-[cyclopentyl(2-hydroxyethyl)amino]pentan-2-one
CID 64696261
3-[cyclobutyl(methyl)amino]-N'-hydroxybutanimidamide
CID 104873509
3-[(4-aminocyclohexyl)-methylamino]butanoic acid
CID 79121835
3-[(4-ethylcyclohexyl)-methylamino]butanoic acid
CID 61449261
1-[cyclopentyl(methyl)amino]propan-1-ol
CID 175919705
3-[methyl(thian-3-yl)amino]butanoic acid
CID 110838575
2-[cyclohexyl(methyl)amino]propanoic acid
CID 22906743
(2S)-2-[cyclopentyl(methyl)amino]propanoic acid;hydrochloride
CID 69352302
1-[cyclopentyl(methyl)amino]-3-methylbutan-2-one
CID 79395457
methyl 3-[methyl(piperidin-4-yl)amino]butanoate
CID 43607263
ethane;N-methyl-N-propan-2-ylcyclohexanamine;propane
CID 142239228

Frequently Asked Questions

What is the IUPAC name of 4-[cyclopentyl(methyl)amino]pentan-2-one?
The IUPAC name of 4-[cyclopentyl(methyl)amino]pentan-2-one (CID 64698717) is 4-[cyclopentyl(methyl)amino]pentan-2-one.
What is the SMILES notation for 4-[cyclopentyl(methyl)amino]pentan-2-one?
The canonical SMILES for 4-[cyclopentyl(methyl)amino]pentan-2-one is CC(=O)CC(C)N(C)C1CCCC1.
What is the InChIKey of 4-[cyclopentyl(methyl)amino]pentan-2-one?
The InChIKey is LITBPBSHQOKGDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-9(8-10(2)13)12(3)11-6-4-5-7-11/h9,11H,4-8H2,1-3H3.
What are the key properties of 4-[cyclopentyl(methyl)amino]pentan-2-one?
4-[cyclopentyl(methyl)amino]pentan-2-one has a molecular weight of 183.29 g/mol, XLogP of 2.23, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[cyclopentyl(methyl)amino]pentan-2-one is sourced from PubChem (CID 64698717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).