1-[(2-methylcyclopentyl)amino]-3-(4-methylpentan-2-yloxy)propan-2-ol

C15H31NO2 — CID 55172046

IUPAC1-[(2-methylcyclopentyl)amino]-3-(4-methylpentan-2-yloxy)propan-2-ol
SMILESCC(C)CC(C)OCC(O)CNC1CCCC1C
InChIInChI=1S/C15H31NO2/c1-11(2)8-13(4)18-10-14(17)9-16-15-7-5-6-12(15)3/h11-17H,5-10H2,1-4H3
InChIKeyHZORDHWFWIXJHK-UHFFFAOYSA-N
MW257.42 g/mol
LogP2.58
Rot. Bonds8

About 1-[(2-methylcyclopentyl)amino]-3-(4-methylpentan-2-yloxy)propan-2-ol

1-[(2-methylcyclopentyl)amino]-3-(4-methylpentan-2-yloxy)propan-2-ol (PubChem CID 55172046) has the molecular formula C15H31NO2 and a molecular weight of 257.42 g/mol. Its IUPAC name is 1-[(2-methylcyclopentyl)amino]-3-(4-methylpentan-2-yloxy)propan-2-ol.

Molecular Properties

Compound Name1-[(2-methylcyclopentyl)amino]-3-(4-methylpentan-2-yloxy)propan-2-ol
PubChem CID55172046
Molecular FormulaC15H31NO2
Molecular Weight257.42 g/mol
Exact Mass257.24
IUPAC Name1-[(2-methylcyclopentyl)amino]-3-(4-methylpentan-2-yloxy)propan-2-ol
SMILESCC(C)CC(C)OCC(O)CNC1CCCC1C
InChIInChI=1S/C15H31NO2/c1-11(2)8-13(4)18-10-14(17)9-16-15-7-5-6-12(15)3/h11-17H,5-10H2,1-4H3
InChIKeyHZORDHWFWIXJHK-UHFFFAOYSA-N
XLogP2.58
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.42
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclohexyloxy-3-[(2-methylcyclopentyl)amino]propan-2-ol
CID 63278409
1-ethoxy-3-[(2-methylcyclohexyl)amino]propan-2-ol
CID 63933567
(2R)-1-[[(1R,2R)-2-methylcyclopentyl]amino]propan-2-ol
CID 95377482
(2S)-1-[(2-methylcyclopentyl)amino]propan-2-ol
CID 103884041
1-(1-azabicyclo[2.2.2]octan-3-ylamino)-3-(4-methylpentan-2-yloxy)propan-2-ol
CID 60899801
1-(2-ethylcyclohexyl)oxy-3-[(2-methylcyclopentyl)amino]propan-2-ol
CID 63281525
1-[[(1R)-1-cyclopentylethyl]amino]-3-(4-methylpentan-2-yloxy)propan-2-ol
CID 81396507
1-(4-methylpentan-2-yloxy)-3-(oxolan-3-ylamino)propan-2-ol
CID 80714149
1-(3,5-dimethylphenoxy)-3-[(2-methylcyclopentyl)amino]propan-2-ol
CID 63278408
1-[(2-methylcyclopropyl)amino]-3-propan-2-yloxypropan-2-ol
CID 62396754
3-[(2-methylcycloheptyl)amino]propane-1,2-diol
CID 77073747
1-[(2-methylcyclohexyl)amino]-3-octoxypropan-2-ol
CID 60632322

Frequently Asked Questions

What is the IUPAC name of 1-[(2-methylcyclopentyl)amino]-3-(4-methylpentan-2-yloxy)propan-2-ol?
The IUPAC name of 1-[(2-methylcyclopentyl)amino]-3-(4-methylpentan-2-yloxy)propan-2-ol (CID 55172046) is 1-[(2-methylcyclopentyl)amino]-3-(4-methylpentan-2-yloxy)propan-2-ol.
What is the SMILES notation for 1-[(2-methylcyclopentyl)amino]-3-(4-methylpentan-2-yloxy)propan-2-ol?
The canonical SMILES for 1-[(2-methylcyclopentyl)amino]-3-(4-methylpentan-2-yloxy)propan-2-ol is CC(C)CC(C)OCC(O)CNC1CCCC1C.
What is the InChIKey of 1-[(2-methylcyclopentyl)amino]-3-(4-methylpentan-2-yloxy)propan-2-ol?
The InChIKey is HZORDHWFWIXJHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO2/c1-11(2)8-13(4)18-10-14(17)9-16-15-7-5-6-12(15)3/h11-17H,5-10H2,1-4H3.
What are the key properties of 1-[(2-methylcyclopentyl)amino]-3-(4-methylpentan-2-yloxy)propan-2-ol?
1-[(2-methylcyclopentyl)amino]-3-(4-methylpentan-2-yloxy)propan-2-ol has a molecular weight of 257.42 g/mol, XLogP of 2.58, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methylcyclopentyl)amino]-3-(4-methylpentan-2-yloxy)propan-2-ol is sourced from PubChem (CID 55172046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).