1-[(2-cyclobutyl-2-methylpropyl)amino]propan-2-one

C11H21NO — CID 115235348

IUPAC1-[(2-cyclobutyl-2-methylpropyl)amino]propan-2-one
SMILESCC(=O)CNCC(C)(C)C1CCC1
InChIInChI=1S/C11H21NO/c1-9(13)7-12-8-11(2,3)10-5-4-6-10/h10,12H,4-8H2,1-3H3
InChIKeyHHDAPYOPYFFEQU-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.99
Rot. Bonds5

About 1-[(2-cyclobutyl-2-methylpropyl)amino]propan-2-one

1-[(2-cyclobutyl-2-methylpropyl)amino]propan-2-one (PubChem CID 115235348) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 1-[(2-cyclobutyl-2-methylpropyl)amino]propan-2-one.

Molecular Properties

Compound Name1-[(2-cyclobutyl-2-methylpropyl)amino]propan-2-one
PubChem CID115235348
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name1-[(2-cyclobutyl-2-methylpropyl)amino]propan-2-one
SMILESCC(=O)CNCC(C)(C)C1CCC1
InChIInChI=1S/C11H21NO/c1-9(13)7-12-8-11(2,3)10-5-4-6-10/h10,12H,4-8H2,1-3H3
InChIKeyHHDAPYOPYFFEQU-UHFFFAOYSA-N
XLogP1.99
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 2-[(2-cyclopentyl-2-methylpropyl)amino]acetate
CID 115233257
1-N-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,2-diamine
CID 115136380
1-(cyclobutylmethylamino)propan-2-one
CID 115234815
2-cyclobutyl-N-(hydrazinylmethyl)-2-methylpropan-1-amine
CID 115261517
N-(2-cyclobutyl-2-methylpropyl)-2-sulfanylacetamide
CID 115167608
5-[(2-cyclobutyl-2-methylpropyl)amino]-4-hydroxypentanoic acid
CID 115122837
methyl 2-[[2-methyl-2-(oxan-4-yl)propyl]amino]acetate
CID 115233259
2-[(2-cyclohexyl-2-methylpropyl)amino]acetaldehyde
CID 115223611
2-[(2-cyclohexyl-2-methylpropyl)amino]ethanol
CID 115216597
4-[[(2-cyclobutyl-2-methylpropyl)amino]methyl]-N-methylcyclohexan-1-amine
CID 115213767
1-(2,2-difluoropropylamino)propan-2-one
CID 143630072
methyl 4-[(2-cyclopentyl-2-methylpropyl)amino]butanoate
CID 115233556

Frequently Asked Questions

What is the IUPAC name of 1-[(2-cyclobutyl-2-methylpropyl)amino]propan-2-one?
The IUPAC name of 1-[(2-cyclobutyl-2-methylpropyl)amino]propan-2-one (CID 115235348) is 1-[(2-cyclobutyl-2-methylpropyl)amino]propan-2-one.
What is the SMILES notation for 1-[(2-cyclobutyl-2-methylpropyl)amino]propan-2-one?
The canonical SMILES for 1-[(2-cyclobutyl-2-methylpropyl)amino]propan-2-one is CC(=O)CNCC(C)(C)C1CCC1.
What is the InChIKey of 1-[(2-cyclobutyl-2-methylpropyl)amino]propan-2-one?
The InChIKey is HHDAPYOPYFFEQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-9(13)7-12-8-11(2,3)10-5-4-6-10/h10,12H,4-8H2,1-3H3.
What are the key properties of 1-[(2-cyclobutyl-2-methylpropyl)amino]propan-2-one?
1-[(2-cyclobutyl-2-methylpropyl)amino]propan-2-one has a molecular weight of 183.29 g/mol, XLogP of 1.99, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-cyclobutyl-2-methylpropyl)amino]propan-2-one is sourced from PubChem (CID 115235348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).