2-(cyclopropylamino)-2-ethyl-5-(2,2,6-trimethylmorpholin-4-yl)pentan-1-ol

C17H34N2O2 — CID 106808951

IUPAC2-(cyclopropylamino)-2-ethyl-5-(2,2,6-trimethylmorpholin-4-yl)pentan-1-ol
SMILESCCC(CO)(CCCN1CC(C)OC(C)(C)C1)NC1CC1
InChIInChI=1S/C17H34N2O2/c1-5-17(13-20,18-15-7-8-15)9-6-10-19-11-14(2)21-16(3,4)12-19/h14-15,18,20H,5-13H2,1-4H3
InChIKeyKXZDQJZHMKUTNP-UHFFFAOYSA-N
MW298.47 g/mol
LogP2.16
Rot. Bonds8

About 2-(cyclopropylamino)-2-ethyl-5-(2,2,6-trimethylmorpholin-4-yl)pentan-1-ol

2-(cyclopropylamino)-2-ethyl-5-(2,2,6-trimethylmorpholin-4-yl)pentan-1-ol (PubChem CID 106808951) has the molecular formula C17H34N2O2 and a molecular weight of 298.47 g/mol. Its IUPAC name is 2-(cyclopropylamino)-2-ethyl-5-(2,2,6-trimethylmorpholin-4-yl)pentan-1-ol.

Molecular Properties

Compound Name2-(cyclopropylamino)-2-ethyl-5-(2,2,6-trimethylmorpholin-4-yl)pentan-1-ol
PubChem CID106808951
Molecular FormulaC17H34N2O2
Molecular Weight298.47 g/mol
Exact Mass298.26
IUPAC Name2-(cyclopropylamino)-2-ethyl-5-(2,2,6-trimethylmorpholin-4-yl)pentan-1-ol
SMILESCCC(CO)(CCCN1CC(C)OC(C)(C)C1)NC1CC1
InChIInChI=1S/C17H34N2O2/c1-5-17(13-20,18-15-7-8-15)9-6-10-19-11-14(2)21-16(3,4)12-19/h14-15,18,20H,5-13H2,1-4H3
InChIKeyKXZDQJZHMKUTNP-UHFFFAOYSA-N
XLogP2.16
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.47
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-2-ethyl-5-(2,2,6-trimethylmorpholin-4-yl)pentan-1-ol?
The IUPAC name of 2-(cyclopropylamino)-2-ethyl-5-(2,2,6-trimethylmorpholin-4-yl)pentan-1-ol (CID 106808951) is 2-(cyclopropylamino)-2-ethyl-5-(2,2,6-trimethylmorpholin-4-yl)pentan-1-ol.
What is the SMILES notation for 2-(cyclopropylamino)-2-ethyl-5-(2,2,6-trimethylmorpholin-4-yl)pentan-1-ol?
The canonical SMILES for 2-(cyclopropylamino)-2-ethyl-5-(2,2,6-trimethylmorpholin-4-yl)pentan-1-ol is CCC(CO)(CCCN1CC(C)OC(C)(C)C1)NC1CC1.
What is the InChIKey of 2-(cyclopropylamino)-2-ethyl-5-(2,2,6-trimethylmorpholin-4-yl)pentan-1-ol?
The InChIKey is KXZDQJZHMKUTNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O2/c1-5-17(13-20,18-15-7-8-15)9-6-10-19-11-14(2)21-16(3,4)12-19/h14-15,18,20H,5-13H2,1-4H3.
What are the key properties of 2-(cyclopropylamino)-2-ethyl-5-(2,2,6-trimethylmorpholin-4-yl)pentan-1-ol?
2-(cyclopropylamino)-2-ethyl-5-(2,2,6-trimethylmorpholin-4-yl)pentan-1-ol has a molecular weight of 298.47 g/mol, XLogP of 2.16, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-2-ethyl-5-(2,2,6-trimethylmorpholin-4-yl)pentan-1-ol is sourced from PubChem (CID 106808951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).