[1-[3-(dimethylamino)propylamino]cyclobutyl]methanol

C10H22N2O — CID 114525313

IUPAC[1-[3-(dimethylamino)propylamino]cyclobutyl]methanol
SMILESCN(C)CCCNC1(CO)CCC1
InChIInChI=1S/C10H22N2O/c1-12(2)8-4-7-11-10(9-13)5-3-6-10/h11,13H,3-9H2,1-2H3
InChIKeyLQFGJCOVHMBIFC-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.44
Rot. Bonds6

About [1-[3-(dimethylamino)propylamino]cyclobutyl]methanol

[1-[3-(dimethylamino)propylamino]cyclobutyl]methanol (PubChem CID 114525313) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is [1-[3-(dimethylamino)propylamino]cyclobutyl]methanol.

Molecular Properties

Compound Name[1-[3-(dimethylamino)propylamino]cyclobutyl]methanol
PubChem CID114525313
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name[1-[3-(dimethylamino)propylamino]cyclobutyl]methanol
SMILESCN(C)CCCNC1(CO)CCC1
InChIInChI=1S/C10H22N2O/c1-12(2)8-4-7-11-10(9-13)5-3-6-10/h11,13H,3-9H2,1-2H3
InChIKeyLQFGJCOVHMBIFC-UHFFFAOYSA-N
XLogP0.44
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

[1-(butylamino)cyclohexyl]methanol
CID 62520970
[4-[2-(dimethylamino)ethylamino]thian-4-yl]methanol
CID 61337984
[1-(2-methylsulfanylethylamino)cyclohexyl]methanol
CID 115909619
4-[[1-(hydroxymethyl)cyclohexyl]amino]-N,N-dimethylbutanamide
CID 62522036
1-[3-(dimethylamino)propylamino]cyclopropane-1-carboxylic acid
CID 114525928
[1-(hexylamino)cyclohexyl]methanol
CID 62519893
N-[1-(aminomethyl)cyclobutyl]-N',N'-dimethylethane-1,2-diamine
CID 79520919
[1-(3-fluoropropylamino)cyclohexyl]methanol
CID 81106456
6-[(1-ethylcyclobutyl)amino]hexan-1-ol
CID 107703649
2-[3-(dimethylamino)propylamino]ethanol;dihydrochloride
CID 21254466
1-[[3-(dimethylamino)propylamino]methyl]cyclopentan-1-ol
CID 65211357
[1-[[4-(dimethylamino)butylamino]methyl]cyclohexyl]methanol
CID 81419638

Frequently Asked Questions

What is the IUPAC name of [1-[3-(dimethylamino)propylamino]cyclobutyl]methanol?
The IUPAC name of [1-[3-(dimethylamino)propylamino]cyclobutyl]methanol (CID 114525313) is [1-[3-(dimethylamino)propylamino]cyclobutyl]methanol.
What is the SMILES notation for [1-[3-(dimethylamino)propylamino]cyclobutyl]methanol?
The canonical SMILES for [1-[3-(dimethylamino)propylamino]cyclobutyl]methanol is CN(C)CCCNC1(CO)CCC1.
What is the InChIKey of [1-[3-(dimethylamino)propylamino]cyclobutyl]methanol?
The InChIKey is LQFGJCOVHMBIFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-12(2)8-4-7-11-10(9-13)5-3-6-10/h11,13H,3-9H2,1-2H3.
What are the key properties of [1-[3-(dimethylamino)propylamino]cyclobutyl]methanol?
[1-[3-(dimethylamino)propylamino]cyclobutyl]methanol has a molecular weight of 186.30 g/mol, XLogP of 0.44, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[3-(dimethylamino)propylamino]cyclobutyl]methanol is sourced from PubChem (CID 114525313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).