2-(cyclopropylamino)-5-(3,5-dimethylpiperidin-1-yl)-2-methylpentan-1-ol

C16H32N2O — CID 64798617

IUPAC2-(cyclopropylamino)-5-(3,5-dimethylpiperidin-1-yl)-2-methylpentan-1-ol
SMILESCC1CC(C)CN(CCCC(C)(CO)NC2CC2)C1
InChIInChI=1S/C16H32N2O/c1-13-9-14(2)11-18(10-13)8-4-7-16(3,12-19)17-15-5-6-15/h13-15,17,19H,4-12H2,1-3H3
InChIKeyHVWXYGQIXAUDQG-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.25
Rot. Bonds7

About 2-(cyclopropylamino)-5-(3,5-dimethylpiperidin-1-yl)-2-methylpentan-1-ol

2-(cyclopropylamino)-5-(3,5-dimethylpiperidin-1-yl)-2-methylpentan-1-ol (PubChem CID 64798617) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 2-(cyclopropylamino)-5-(3,5-dimethylpiperidin-1-yl)-2-methylpentan-1-ol.

Molecular Properties

Compound Name2-(cyclopropylamino)-5-(3,5-dimethylpiperidin-1-yl)-2-methylpentan-1-ol
PubChem CID64798617
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name2-(cyclopropylamino)-5-(3,5-dimethylpiperidin-1-yl)-2-methylpentan-1-ol
SMILESCC1CC(C)CN(CCCC(C)(CO)NC2CC2)C1
InChIInChI=1S/C16H32N2O/c1-13-9-14(2)11-18(10-13)8-4-7-16(3,12-19)17-15-5-6-15/h13-15,17,19H,4-12H2,1-3H3
InChIKeyHVWXYGQIXAUDQG-UHFFFAOYSA-N
XLogP2.25
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylamino)-2-methyl-5-pyrrolidin-1-ylpentan-1-ol
CID 64798628
2-(cyclopropylamino)-2-methyl-6-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)hexan-1-ol
CID 66369677
2-(cyclopropylamino)-5-(2,4-dimethylpiperidin-1-yl)-2-methylpentan-1-ol
CID 64788184
6-(3,5-dimethylpiperidin-1-yl)-2-methyl-2-(propylamino)hexan-1-ol
CID 64796258
2-(cyclopropylamino)-5-[3-(methoxymethyl)pyrrolidin-1-yl]-2-methylpentan-1-ol
CID 64809590
2-methyl-2-(methylamino)-5-(3,4,5-trimethylpiperazin-1-yl)pentan-1-ol
CID 114540881
2-(cyclopropylamino)-5-(3,5-dimethylcyclohexyl)oxy-2-methylpentan-1-ol
CID 64808158
5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-methyl-2-(methylamino)pentan-1-ol
CID 104961381
2-(cyclopropylamino)-6-(3,5-dimethylcyclohexyl)oxy-2-methylhexan-1-ol
CID 64807530
2-(cyclopropylamino)-2-methyl-6-(2,2,6-trimethylmorpholin-4-yl)hexan-1-ol
CID 64790148
2-(cyclopropylamino)-5-(3-ethoxypiperidin-1-yl)-2-methylpentan-1-ol
CID 64827238
2-(cyclopropylamino)-2-methyl-3-(3-methylpyrrolidin-1-yl)propan-1-ol
CID 64828276

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-5-(3,5-dimethylpiperidin-1-yl)-2-methylpentan-1-ol?
The IUPAC name of 2-(cyclopropylamino)-5-(3,5-dimethylpiperidin-1-yl)-2-methylpentan-1-ol (CID 64798617) is 2-(cyclopropylamino)-5-(3,5-dimethylpiperidin-1-yl)-2-methylpentan-1-ol.
What is the SMILES notation for 2-(cyclopropylamino)-5-(3,5-dimethylpiperidin-1-yl)-2-methylpentan-1-ol?
The canonical SMILES for 2-(cyclopropylamino)-5-(3,5-dimethylpiperidin-1-yl)-2-methylpentan-1-ol is CC1CC(C)CN(CCCC(C)(CO)NC2CC2)C1.
What is the InChIKey of 2-(cyclopropylamino)-5-(3,5-dimethylpiperidin-1-yl)-2-methylpentan-1-ol?
The InChIKey is HVWXYGQIXAUDQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-13-9-14(2)11-18(10-13)8-4-7-16(3,12-19)17-15-5-6-15/h13-15,17,19H,4-12H2,1-3H3.
What are the key properties of 2-(cyclopropylamino)-5-(3,5-dimethylpiperidin-1-yl)-2-methylpentan-1-ol?
2-(cyclopropylamino)-5-(3,5-dimethylpiperidin-1-yl)-2-methylpentan-1-ol has a molecular weight of 268.44 g/mol, XLogP of 2.25, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-5-(3,5-dimethylpiperidin-1-yl)-2-methylpentan-1-ol is sourced from PubChem (CID 64798617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).