1-[1-(dimethylamino)cyclohexyl]propan-2-one

C11H21NO — CID 58143295

IUPAC1-[1-(dimethylamino)cyclohexyl]propan-2-one
SMILESCC(=O)CC1(N(C)C)CCCCC1
InChIInChI=1S/C11H21NO/c1-10(13)9-11(12(2)3)7-5-4-6-8-11/h4-9H2,1-3H3
InChIKeyDMSKEZUUFYERGQ-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.23
Rot. Bonds3

About 1-[1-(dimethylamino)cyclohexyl]propan-2-one

1-[1-(dimethylamino)cyclohexyl]propan-2-one (PubChem CID 58143295) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 1-[1-(dimethylamino)cyclohexyl]propan-2-one.

Molecular Properties

Compound Name1-[1-(dimethylamino)cyclohexyl]propan-2-one
PubChem CID58143295
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name1-[1-(dimethylamino)cyclohexyl]propan-2-one
SMILESCC(=O)CC1(N(C)C)CCCCC1
InChIInChI=1S/C11H21NO/c1-10(13)9-11(12(2)3)7-5-4-6-8-11/h4-9H2,1-3H3
InChIKeyDMSKEZUUFYERGQ-UHFFFAOYSA-N
XLogP2.23
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
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

2-[1-(dimethylamino)cycloheptyl]acetic acid
CID 64526393
2-[1-(dimethylamino)cyclohexyl]acetamide
CID 10845205
1-[1-(dimethylamino)cyclopent-3-en-1-yl]propan-2-one
CID 58143359
N-[[1-(dimethylamino)cyclopentyl]methyl]-3-oxobutanamide
CID 83109875
2-[1-[acetyl(methyl)amino]cyclohexyl]acetic acid
CID 65238588
1-[2-(dimethylamino)-3,4-dihydro-1H-naphthalen-2-yl]propan-2-one
CID 58143304
N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-2-[1-(methylamino)cyclohexyl]acetamide
CID 105417592
1-(2-oxopropyl)cyclohexane-1-carboxamide
CID 20653176
2-[1-[methyl(propanoyl)amino]cyclohexyl]acetic acid
CID 65242914
2-[1-[formyl(methyl)amino]cyclohexyl]acetic acid
CID 65242680
N,N'-bis[[1-(dimethylamino)cyclohexyl]methyl]-3-methylpentanediamide
CID 167805292
N-[4-[[1-(dimethylamino)cyclohexyl]methylcarbamothioyl]phenyl]acetamide
CID 2538200

Frequently Asked Questions

What is the IUPAC name of 1-[1-(dimethylamino)cyclohexyl]propan-2-one?
The IUPAC name of 1-[1-(dimethylamino)cyclohexyl]propan-2-one (CID 58143295) is 1-[1-(dimethylamino)cyclohexyl]propan-2-one.
What is the SMILES notation for 1-[1-(dimethylamino)cyclohexyl]propan-2-one?
The canonical SMILES for 1-[1-(dimethylamino)cyclohexyl]propan-2-one is CC(=O)CC1(N(C)C)CCCCC1.
What is the InChIKey of 1-[1-(dimethylamino)cyclohexyl]propan-2-one?
The InChIKey is DMSKEZUUFYERGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-10(13)9-11(12(2)3)7-5-4-6-8-11/h4-9H2,1-3H3.
What are the key properties of 1-[1-(dimethylamino)cyclohexyl]propan-2-one?
1-[1-(dimethylamino)cyclohexyl]propan-2-one has a molecular weight of 183.29 g/mol, XLogP of 2.23, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(dimethylamino)cyclohexyl]propan-2-one is sourced from PubChem (CID 58143295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).