1-cyclopentyl-3-[1-cyclopropylethyl(2-methoxyethyl)amino]propan-2-ol

C16H31NO2 — CID 103159910

IUPAC1-cyclopentyl-3-[1-cyclopropylethyl(2-methoxyethyl)amino]propan-2-ol
SMILESCOCCN(CC(O)CC1CCCC1)C(C)C1CC1
InChIInChI=1S/C16H31NO2/c1-13(15-7-8-15)17(9-10-19-2)12-16(18)11-14-5-3-4-6-14/h13-16,18H,3-12H2,1-2H3
InChIKeyHOBKVHWUBQADOD-UHFFFAOYSA-N
MW269.43 g/mol
LogP2.67
Rot. Bonds9

About 1-cyclopentyl-3-[1-cyclopropylethyl(2-methoxyethyl)amino]propan-2-ol

1-cyclopentyl-3-[1-cyclopropylethyl(2-methoxyethyl)amino]propan-2-ol (PubChem CID 103159910) has the molecular formula C16H31NO2 and a molecular weight of 269.43 g/mol. Its IUPAC name is 1-cyclopentyl-3-[1-cyclopropylethyl(2-methoxyethyl)amino]propan-2-ol.

Molecular Properties

Compound Name1-cyclopentyl-3-[1-cyclopropylethyl(2-methoxyethyl)amino]propan-2-ol
PubChem CID103159910
Molecular FormulaC16H31NO2
Molecular Weight269.43 g/mol
Exact Mass269.24
IUPAC Name1-cyclopentyl-3-[1-cyclopropylethyl(2-methoxyethyl)amino]propan-2-ol
SMILESCOCCN(CC(O)CC1CCCC1)C(C)C1CC1
InChIInChI=1S/C16H31NO2/c1-13(15-7-8-15)17(9-10-19-2)12-16(18)11-14-5-3-4-6-14/h13-16,18H,3-12H2,1-2H3
InChIKeyHOBKVHWUBQADOD-UHFFFAOYSA-N
XLogP2.67
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-Cyclopentyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-2-ol
CID 103159925
7-Ethyl-1-methyl-10-(2-methylhexan-3-yl)-3-[methyl-[(3-methyloxiran-2-yl)methyl]amino]bicyclo[8.2.1]tridecan-4-ol
CID 90856165
(4R)-2,4,10-trimethyl-2-azabicyclo[10.1.0]tridecan-13-ol
CID 166765809
CID 10883482
CID 10883482
CID 11025385
CID 11025385
CID 11337704
CID 11337704
2-[[2-Methoxyethyl(1-methoxypropan-2-yl)amino]methyl]cycloheptan-1-ol
CID 55094347
2-[[2-Methoxyethyl(pentan-3-yl)amino]methyl]cyclopentan-1-ol
CID 55094397
2-[[Ethyl(1-methoxypropan-2-yl)amino]methyl]cycloheptan-1-ol
CID 55094769
2-[[1-Cyclopropylethyl(2-methoxyethyl)amino]methyl]cycloheptan-1-ol
CID 55094819
2-[[Butan-2-yl(2-methoxyethyl)amino]methyl]cycloheptan-1-ol
CID 55094961
2-[Cyclopropyl(2-methoxyethyl)amino]-4-propylcyclohexan-1-ol
CID 61765588

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-[1-cyclopropylethyl(2-methoxyethyl)amino]propan-2-ol?
The IUPAC name of 1-cyclopentyl-3-[1-cyclopropylethyl(2-methoxyethyl)amino]propan-2-ol (CID 103159910) is 1-cyclopentyl-3-[1-cyclopropylethyl(2-methoxyethyl)amino]propan-2-ol.
What is the SMILES notation for 1-cyclopentyl-3-[1-cyclopropylethyl(2-methoxyethyl)amino]propan-2-ol?
The canonical SMILES for 1-cyclopentyl-3-[1-cyclopropylethyl(2-methoxyethyl)amino]propan-2-ol is COCCN(CC(O)CC1CCCC1)C(C)C1CC1.
What is the InChIKey of 1-cyclopentyl-3-[1-cyclopropylethyl(2-methoxyethyl)amino]propan-2-ol?
The InChIKey is HOBKVHWUBQADOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO2/c1-13(15-7-8-15)17(9-10-19-2)12-16(18)11-14-5-3-4-6-14/h13-16,18H,3-12H2,1-2H3.
What are the key properties of 1-cyclopentyl-3-[1-cyclopropylethyl(2-methoxyethyl)amino]propan-2-ol?
1-cyclopentyl-3-[1-cyclopropylethyl(2-methoxyethyl)amino]propan-2-ol has a molecular weight of 269.43 g/mol, XLogP of 2.67, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-[1-cyclopropylethyl(2-methoxyethyl)amino]propan-2-ol is sourced from PubChem (CID 103159910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).