1-cyclopropyl-2-[5-(2-methylpropylamino)-1-propan-2-ylpiperidin-3-yl]ethanol

C17H34N2O — CID 83994301

IUPAC1-cyclopropyl-2-[5-(2-methylpropylamino)-1-propan-2-ylpiperidin-3-yl]ethanol
SMILESCC(C)CNC1CC(CC(O)C2CC2)CN(C(C)C)C1
InChIInChI=1S/C17H34N2O/c1-12(2)9-18-16-7-14(8-17(20)15-5-6-15)10-19(11-16)13(3)4/h12-18,20H,5-11H2,1-4H3
InChIKeyYMLZTJWRXRFXAG-UHFFFAOYSA-N
MW282.47 g/mol
LogP2.49
Rot. Bonds7

About 1-cyclopropyl-2-[5-(2-methylpropylamino)-1-propan-2-ylpiperidin-3-yl]ethanol

1-cyclopropyl-2-[5-(2-methylpropylamino)-1-propan-2-ylpiperidin-3-yl]ethanol (PubChem CID 83994301) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 1-cyclopropyl-2-[5-(2-methylpropylamino)-1-propan-2-ylpiperidin-3-yl]ethanol.

Molecular Properties

Compound Name1-cyclopropyl-2-[5-(2-methylpropylamino)-1-propan-2-ylpiperidin-3-yl]ethanol
PubChem CID83994301
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name1-cyclopropyl-2-[5-(2-methylpropylamino)-1-propan-2-ylpiperidin-3-yl]ethanol
SMILESCC(C)CNC1CC(CC(O)C2CC2)CN(C(C)C)C1
InChIInChI=1S/C17H34N2O/c1-12(2)9-18-16-7-14(8-17(20)15-5-6-15)10-19(11-16)13(3)4/h12-18,20H,5-11H2,1-4H3
InChIKeyYMLZTJWRXRFXAG-UHFFFAOYSA-N
XLogP2.49
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-(2-methylpropylamino)-1-propan-2-ylpiperidin-3-yl]butan-2-ol
CID 83994299
5-(cyclopropylmethyl)-N-(2-methylpropyl)-1-propan-2-ylpiperidin-3-amine
CID 83994285
N-(2-methylpropyl)-1-propan-2-ylazetidin-3-amine
CID 155088141
1-[5-(cyclobutylmethylamino)-1-propan-2-ylpiperidin-3-yl]-3-methylbutan-2-ol
CID 83997066
1-cyclopropyl-2-[1-methyl-5-(methylamino)piperidin-3-yl]ethanol
CID 83989545
1-cyclopropyl-2-[5-(ethylamino)-1-(2-hydroxyethyl)piperidin-3-yl]ethanol
CID 83990741
5-(cyclopropylmethyl)-N-(3-methylbutyl)-1-propan-2-ylpiperidin-3-amine
CID 83995669
1-[3-(2-cyclopropyl-2-hydroxyethyl)-5-(cyclopropylmethylamino)piperidin-1-yl]ethanone
CID 83996454
5-(cyclopropylmethyl)-N-ethyl-1-propan-2-ylpiperidin-3-amine
CID 83990284
1-cyclopropyl-2-[5-(cyclopropylamino)-1-propylpiperidin-3-yl]ethanol
CID 83991509
1-[1-ethyl-5-(2-methylpropylamino)piperidin-3-yl]-3-methylbutan-2-ol
CID 83994194
2-[1-(2-aminoethyl)-5-(2,2-dimethylpropylamino)piperidin-3-yl]-1-cyclopropylethanol
CID 83995501

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-[5-(2-methylpropylamino)-1-propan-2-ylpiperidin-3-yl]ethanol?
The IUPAC name of 1-cyclopropyl-2-[5-(2-methylpropylamino)-1-propan-2-ylpiperidin-3-yl]ethanol (CID 83994301) is 1-cyclopropyl-2-[5-(2-methylpropylamino)-1-propan-2-ylpiperidin-3-yl]ethanol.
What is the SMILES notation for 1-cyclopropyl-2-[5-(2-methylpropylamino)-1-propan-2-ylpiperidin-3-yl]ethanol?
The canonical SMILES for 1-cyclopropyl-2-[5-(2-methylpropylamino)-1-propan-2-ylpiperidin-3-yl]ethanol is CC(C)CNC1CC(CC(O)C2CC2)CN(C(C)C)C1.
What is the InChIKey of 1-cyclopropyl-2-[5-(2-methylpropylamino)-1-propan-2-ylpiperidin-3-yl]ethanol?
The InChIKey is YMLZTJWRXRFXAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-12(2)9-18-16-7-14(8-17(20)15-5-6-15)10-19(11-16)13(3)4/h12-18,20H,5-11H2,1-4H3.
What are the key properties of 1-cyclopropyl-2-[5-(2-methylpropylamino)-1-propan-2-ylpiperidin-3-yl]ethanol?
1-cyclopropyl-2-[5-(2-methylpropylamino)-1-propan-2-ylpiperidin-3-yl]ethanol has a molecular weight of 282.47 g/mol, XLogP of 2.49, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-[5-(2-methylpropylamino)-1-propan-2-ylpiperidin-3-yl]ethanol is sourced from PubChem (CID 83994301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).