2-(cyclopropylamino)-2-ethyl-5-(3-propan-2-ylpyrrolidin-1-yl)pentan-1-ol

C17H34N2O — CID 106809843

IUPAC2-(cyclopropylamino)-2-ethyl-5-(3-propan-2-ylpyrrolidin-1-yl)pentan-1-ol
SMILESCCC(CO)(CCCN1CCC(C(C)C)C1)NC1CC1
InChIInChI=1S/C17H34N2O/c1-4-17(13-20,18-16-6-7-16)9-5-10-19-11-8-15(12-19)14(2)3/h14-16,18,20H,4-13H2,1-3H3
InChIKeyXDOKCMYQSFPRIX-UHFFFAOYSA-N
MW282.47 g/mol
LogP2.64
Rot. Bonds9

About 2-(cyclopropylamino)-2-ethyl-5-(3-propan-2-ylpyrrolidin-1-yl)pentan-1-ol

2-(cyclopropylamino)-2-ethyl-5-(3-propan-2-ylpyrrolidin-1-yl)pentan-1-ol (PubChem CID 106809843) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 2-(cyclopropylamino)-2-ethyl-5-(3-propan-2-ylpyrrolidin-1-yl)pentan-1-ol.

Molecular Properties

Compound Name2-(cyclopropylamino)-2-ethyl-5-(3-propan-2-ylpyrrolidin-1-yl)pentan-1-ol
PubChem CID106809843
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name2-(cyclopropylamino)-2-ethyl-5-(3-propan-2-ylpyrrolidin-1-yl)pentan-1-ol
SMILESCCC(CO)(CCCN1CCC(C(C)C)C1)NC1CC1
InChIInChI=1S/C17H34N2O/c1-4-17(13-20,18-16-6-7-16)9-5-10-19-11-8-15(12-19)14(2)3/h14-16,18,20H,4-13H2,1-3H3
InChIKeyXDOKCMYQSFPRIX-UHFFFAOYSA-N
XLogP2.64
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylamino)-2-ethyl-5-(4-propylpiperidin-1-yl)pentan-1-ol
CID 106808663
2-(cyclopropylamino)-2-ethyl-5-(3-methoxypiperidin-1-yl)pentan-1-ol
CID 106809926
2-(cyclopropylamino)-5-(3,3-diethylpyrrolidin-1-yl)-2-ethylpentan-1-ol
CID 106809757
2-ethyl-5-(3-ethylpyrrolidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol
CID 106809851
2-(cyclopropylamino)-2-ethyl-5-(2-methylpiperidin-1-yl)pentan-1-ol
CID 106809062
2-ethyl-5-(3-methoxypyrrolidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol
CID 106809954
2-(cyclopropylamino)-2-ethyl-5-(2,2,6-trimethylmorpholin-4-yl)pentan-1-ol
CID 106808951
2-(cyclopropylamino)-5-(2,4-dimethylpyrrolidin-1-yl)-2-ethylpentan-1-ol
CID 106809879
2-(cyclopropylamino)-5-(2,2-dimethylpyrrolidin-1-yl)-2-ethylpentan-1-ol
CID 106808854
2-ethyl-5-(3-ethylpiperidin-1-yl)-2-(propan-2-ylamino)pentan-1-ol
CID 106809284
2-(cyclopropylamino)-2-ethyl-5-(2-propylpiperidin-1-yl)pentan-1-ol
CID 106809824
2-(cyclopropylamino)-2-ethyl-5-(3-methylmorpholin-4-yl)pentan-1-ol
CID 106809241

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-2-ethyl-5-(3-propan-2-ylpyrrolidin-1-yl)pentan-1-ol?
The IUPAC name of 2-(cyclopropylamino)-2-ethyl-5-(3-propan-2-ylpyrrolidin-1-yl)pentan-1-ol (CID 106809843) is 2-(cyclopropylamino)-2-ethyl-5-(3-propan-2-ylpyrrolidin-1-yl)pentan-1-ol.
What is the SMILES notation for 2-(cyclopropylamino)-2-ethyl-5-(3-propan-2-ylpyrrolidin-1-yl)pentan-1-ol?
The canonical SMILES for 2-(cyclopropylamino)-2-ethyl-5-(3-propan-2-ylpyrrolidin-1-yl)pentan-1-ol is CCC(CO)(CCCN1CCC(C(C)C)C1)NC1CC1.
What is the InChIKey of 2-(cyclopropylamino)-2-ethyl-5-(3-propan-2-ylpyrrolidin-1-yl)pentan-1-ol?
The InChIKey is XDOKCMYQSFPRIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-4-17(13-20,18-16-6-7-16)9-5-10-19-11-8-15(12-19)14(2)3/h14-16,18,20H,4-13H2,1-3H3.
What are the key properties of 2-(cyclopropylamino)-2-ethyl-5-(3-propan-2-ylpyrrolidin-1-yl)pentan-1-ol?
2-(cyclopropylamino)-2-ethyl-5-(3-propan-2-ylpyrrolidin-1-yl)pentan-1-ol has a molecular weight of 282.47 g/mol, XLogP of 2.64, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-2-ethyl-5-(3-propan-2-ylpyrrolidin-1-yl)pentan-1-ol is sourced from PubChem (CID 106809843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).