[1-(cyclopropylamino)-3-[ethyl(oxolan-2-ylmethyl)amino]cyclohexyl]methanol

C17H32N2O2 — CID 79635541

IUPAC[1-(cyclopropylamino)-3-[ethyl(oxolan-2-ylmethyl)amino]cyclohexyl]methanol
SMILESCCN(CC1CCCO1)C1CCCC(CO)(NC2CC2)C1
InChIInChI=1S/C17H32N2O2/c1-2-19(12-16-6-4-10-21-16)15-5-3-9-17(11-15,13-20)18-14-7-8-14/h14-16,18,20H,2-13H2,1H3
InChIKeyFHZWYQLGEFMDAG-UHFFFAOYSA-N
MW296.45 g/mol
LogP1.91
Rot. Bonds7

About [1-(cyclopropylamino)-3-[ethyl(oxolan-2-ylmethyl)amino]cyclohexyl]methanol

[1-(cyclopropylamino)-3-[ethyl(oxolan-2-ylmethyl)amino]cyclohexyl]methanol (PubChem CID 79635541) has the molecular formula C17H32N2O2 and a molecular weight of 296.45 g/mol. Its IUPAC name is [1-(cyclopropylamino)-3-[ethyl(oxolan-2-ylmethyl)amino]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-(cyclopropylamino)-3-[ethyl(oxolan-2-ylmethyl)amino]cyclohexyl]methanol
PubChem CID79635541
Molecular FormulaC17H32N2O2
Molecular Weight296.45 g/mol
Exact Mass296.25
IUPAC Name[1-(cyclopropylamino)-3-[ethyl(oxolan-2-ylmethyl)amino]cyclohexyl]methanol
SMILESCCN(CC1CCCO1)C1CCCC(CO)(NC2CC2)C1
InChIInChI=1S/C17H32N2O2/c1-2-19(12-16-6-4-10-21-16)15-5-3-9-17(11-15,13-20)18-14-7-8-14/h14-16,18,20H,2-13H2,1H3
InChIKeyFHZWYQLGEFMDAG-UHFFFAOYSA-N
XLogP1.91
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.45
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-amino-3-[ethyl(oxolan-2-ylmethyl)amino]cyclopentyl]methanol
CID 79656703
[1-(cyclopropylamino)-3-[3-(dimethylamino)propyl-ethylamino]cyclohexyl]methanol
CID 102998353
[3-[butyl(ethyl)amino]-1-(cyclopropylamino)cyclopentyl]methanol
CID 79656594
[1-(cyclopropylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]cyclohexyl]methanol
CID 79634544
[1-(ethylamino)-3-[methyl(oxan-2-ylmethyl)amino]cyclopentyl]methanol
CID 79657043
[3-[butyl(cyclopropyl)amino]-1-(cyclopropylamino)cyclohexyl]methanol
CID 79640161
1-(cyclopropylamino)-3-[methyl(oxolan-2-ylmethyl)amino]cyclopentane-1-carboxamide
CID 79655154
1-(cyclopropylamino)-3-[methyl(oxan-2-ylmethyl)amino]cyclopentane-1-carboxylic acid
CID 79646403
[1-(cyclopropylamino)-3-[methyl(2-methylpropyl)amino]cyclohexyl]methanol
CID 79634395
1-N-ethyl-1-N-(oxolan-2-ylmethyl)cyclobutane-1,3-diamine
CID 80561605
N-ethyl-N-(oxolan-2-ylmethyl)piperidin-3-amine
CID 61434221
[1-(cyclopropylamino)-3-propan-2-ylcyclohexyl]methanol
CID 107450341

Frequently Asked Questions

What is the IUPAC name of [1-(cyclopropylamino)-3-[ethyl(oxolan-2-ylmethyl)amino]cyclohexyl]methanol?
The IUPAC name of [1-(cyclopropylamino)-3-[ethyl(oxolan-2-ylmethyl)amino]cyclohexyl]methanol (CID 79635541) is [1-(cyclopropylamino)-3-[ethyl(oxolan-2-ylmethyl)amino]cyclohexyl]methanol.
What is the SMILES notation for [1-(cyclopropylamino)-3-[ethyl(oxolan-2-ylmethyl)amino]cyclohexyl]methanol?
The canonical SMILES for [1-(cyclopropylamino)-3-[ethyl(oxolan-2-ylmethyl)amino]cyclohexyl]methanol is CCN(CC1CCCO1)C1CCCC(CO)(NC2CC2)C1.
What is the InChIKey of [1-(cyclopropylamino)-3-[ethyl(oxolan-2-ylmethyl)amino]cyclohexyl]methanol?
The InChIKey is FHZWYQLGEFMDAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O2/c1-2-19(12-16-6-4-10-21-16)15-5-3-9-17(11-15,13-20)18-14-7-8-14/h14-16,18,20H,2-13H2,1H3.
What are the key properties of [1-(cyclopropylamino)-3-[ethyl(oxolan-2-ylmethyl)amino]cyclohexyl]methanol?
[1-(cyclopropylamino)-3-[ethyl(oxolan-2-ylmethyl)amino]cyclohexyl]methanol has a molecular weight of 296.45 g/mol, XLogP of 1.91, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclopropylamino)-3-[ethyl(oxolan-2-ylmethyl)amino]cyclohexyl]methanol is sourced from PubChem (CID 79635541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).