[1-(cyclopropylamino)-3-(3-methoxy-4-methylpiperidin-1-yl)cyclopentyl]methanol

C16H30N2O2 — CID 102968918

IUPAC[1-(cyclopropylamino)-3-(3-methoxy-4-methylpiperidin-1-yl)cyclopentyl]methanol
SMILESCOC1CN(C2CCC(CO)(NC3CC3)C2)CCC1C
InChIInChI=1S/C16H30N2O2/c1-12-6-8-18(10-15(12)20-2)14-5-7-16(9-14,11-19)17-13-3-4-13/h12-15,17,19H,3-11H2,1-2H3
InChIKeyLAVGZUDDKMPOAL-UHFFFAOYSA-N
MW282.43 g/mol
LogP1.38
Rot. Bonds5

About [1-(cyclopropylamino)-3-(3-methoxy-4-methylpiperidin-1-yl)cyclopentyl]methanol

[1-(cyclopropylamino)-3-(3-methoxy-4-methylpiperidin-1-yl)cyclopentyl]methanol (PubChem CID 102968918) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is [1-(cyclopropylamino)-3-(3-methoxy-4-methylpiperidin-1-yl)cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(cyclopropylamino)-3-(3-methoxy-4-methylpiperidin-1-yl)cyclopentyl]methanol
PubChem CID102968918
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC Name[1-(cyclopropylamino)-3-(3-methoxy-4-methylpiperidin-1-yl)cyclopentyl]methanol
SMILESCOC1CN(C2CCC(CO)(NC3CC3)C2)CCC1C
InChIInChI=1S/C16H30N2O2/c1-12-6-8-18(10-15(12)20-2)14-5-7-16(9-14,11-19)17-13-3-4-13/h12-15,17,19H,3-11H2,1-2H3
InChIKeyLAVGZUDDKMPOAL-UHFFFAOYSA-N
XLogP1.38
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-(cyclopropylamino)-3-(3-methoxy-4-methylpiperidin-1-yl)cyclopentyl]methanol?
The IUPAC name of [1-(cyclopropylamino)-3-(3-methoxy-4-methylpiperidin-1-yl)cyclopentyl]methanol (CID 102968918) is [1-(cyclopropylamino)-3-(3-methoxy-4-methylpiperidin-1-yl)cyclopentyl]methanol.
What is the SMILES notation for [1-(cyclopropylamino)-3-(3-methoxy-4-methylpiperidin-1-yl)cyclopentyl]methanol?
The canonical SMILES for [1-(cyclopropylamino)-3-(3-methoxy-4-methylpiperidin-1-yl)cyclopentyl]methanol is COC1CN(C2CCC(CO)(NC3CC3)C2)CCC1C.
What is the InChIKey of [1-(cyclopropylamino)-3-(3-methoxy-4-methylpiperidin-1-yl)cyclopentyl]methanol?
The InChIKey is LAVGZUDDKMPOAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-12-6-8-18(10-15(12)20-2)14-5-7-16(9-14,11-19)17-13-3-4-13/h12-15,17,19H,3-11H2,1-2H3.
What are the key properties of [1-(cyclopropylamino)-3-(3-methoxy-4-methylpiperidin-1-yl)cyclopentyl]methanol?
[1-(cyclopropylamino)-3-(3-methoxy-4-methylpiperidin-1-yl)cyclopentyl]methanol has a molecular weight of 282.43 g/mol, XLogP of 1.38, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclopropylamino)-3-(3-methoxy-4-methylpiperidin-1-yl)cyclopentyl]methanol is sourced from PubChem (CID 102968918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).