[3-[3-(diethylamino)propyl-ethylamino]-1-(ethylamino)cyclopentyl]methanol

C17H37N3O — CID 102998427

IUPAC[3-[3-(diethylamino)propyl-ethylamino]-1-(ethylamino)cyclopentyl]methanol
SMILESCCNC1(CO)CCC(N(CC)CCCN(CC)CC)C1
InChIInChI=1S/C17H37N3O/c1-5-18-17(15-21)11-10-16(14-17)20(8-4)13-9-12-19(6-2)7-3/h16,18,21H,5-15H2,1-4H3
InChIKeyCJRCVRYLZFIRKD-UHFFFAOYSA-N
MW299.50 g/mol
LogP1.93
Rot. Bonds11

About [3-[3-(diethylamino)propyl-ethylamino]-1-(ethylamino)cyclopentyl]methanol

[3-[3-(diethylamino)propyl-ethylamino]-1-(ethylamino)cyclopentyl]methanol (PubChem CID 102998427) has the molecular formula C17H37N3O and a molecular weight of 299.50 g/mol. Its IUPAC name is [3-[3-(diethylamino)propyl-ethylamino]-1-(ethylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[3-[3-(diethylamino)propyl-ethylamino]-1-(ethylamino)cyclopentyl]methanol
PubChem CID102998427
Molecular FormulaC17H37N3O
Molecular Weight299.50 g/mol
Exact Mass299.29
IUPAC Name[3-[3-(diethylamino)propyl-ethylamino]-1-(ethylamino)cyclopentyl]methanol
SMILESCCNC1(CO)CCC(N(CC)CCCN(CC)CC)C1
InChIInChI=1S/C17H37N3O/c1-5-18-17(15-21)11-10-16(14-17)20(8-4)13-9-12-19(6-2)7-3/h16,18,21H,5-15H2,1-4H3
InChIKeyCJRCVRYLZFIRKD-UHFFFAOYSA-N
XLogP1.93
TPSA38.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.50
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[3-[butyl(ethyl)amino]-1-(ethylamino)cyclohexyl]methanol
CID 79633810
[3-[butyl(cyclopropyl)amino]-1-(ethylamino)cyclopentyl]methanol
CID 79655971
[3-[butyl(ethyl)amino]-1-(cyclopropylamino)cyclopentyl]methanol
CID 79656594
[3-[cycloheptyl(methyl)amino]-1-(ethylamino)cyclopentyl]methanol
CID 79655884
[1-(ethylamino)-3-[methyl(2-methylpropyl)amino]cyclopentyl]methanol
CID 79656684
[1-(cyclopropylamino)-3-[3-(dimethylamino)propyl-ethylamino]cyclohexyl]methanol
CID 102998353
[1-(ethylamino)-3-[methyl-(1-methylpiperidin-4-yl)amino]cyclopentyl]methanol
CID 79656682
[3-[cyclopropylmethyl(ethyl)amino]-1-(propylamino)cyclopentyl]methanol
CID 79656262
[3-[cyclopropyl(2-methylpropyl)amino]-1-(ethylamino)cyclopentyl]methanol
CID 79656461
[1-(ethylamino)-3-[methyl(2-pyrrolidin-1-ylethyl)amino]cyclopentyl]methanol
CID 79656265
[3-(dibutylamino)-1-(propylamino)cyclohexyl]methanol
CID 79633811
[1-(ethylamino)-3-methylsulfanylcyclopentyl]methanol
CID 79646857

Frequently Asked Questions

What is the IUPAC name of [3-[3-(diethylamino)propyl-ethylamino]-1-(ethylamino)cyclopentyl]methanol?
The IUPAC name of [3-[3-(diethylamino)propyl-ethylamino]-1-(ethylamino)cyclopentyl]methanol (CID 102998427) is [3-[3-(diethylamino)propyl-ethylamino]-1-(ethylamino)cyclopentyl]methanol.
What is the SMILES notation for [3-[3-(diethylamino)propyl-ethylamino]-1-(ethylamino)cyclopentyl]methanol?
The canonical SMILES for [3-[3-(diethylamino)propyl-ethylamino]-1-(ethylamino)cyclopentyl]methanol is CCNC1(CO)CCC(N(CC)CCCN(CC)CC)C1.
What is the InChIKey of [3-[3-(diethylamino)propyl-ethylamino]-1-(ethylamino)cyclopentyl]methanol?
The InChIKey is CJRCVRYLZFIRKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H37N3O/c1-5-18-17(15-21)11-10-16(14-17)20(8-4)13-9-12-19(6-2)7-3/h16,18,21H,5-15H2,1-4H3.
What are the key properties of [3-[3-(diethylamino)propyl-ethylamino]-1-(ethylamino)cyclopentyl]methanol?
[3-[3-(diethylamino)propyl-ethylamino]-1-(ethylamino)cyclopentyl]methanol has a molecular weight of 299.50 g/mol, XLogP of 1.93, 11 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[3-(diethylamino)propyl-ethylamino]-1-(ethylamino)cyclopentyl]methanol is sourced from PubChem (CID 102998427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).