2-[1-[(dipropylamino)methyl]cyclopropyl]ethanol

C12H25NO — CID 114757429

IUPAC2-[1-[(dipropylamino)methyl]cyclopropyl]ethanol
SMILESCCCN(CCC)CC1(CCO)CC1
InChIInChI=1S/C12H25NO/c1-3-8-13(9-4-2)11-12(5-6-12)7-10-14/h14H,3-11H2,1-2H3
InChIKeyGSZKJYJFFVWSLL-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.27
Rot. Bonds8

About 2-[1-[(dipropylamino)methyl]cyclopropyl]ethanol

2-[1-[(dipropylamino)methyl]cyclopropyl]ethanol (PubChem CID 114757429) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 2-[1-[(dipropylamino)methyl]cyclopropyl]ethanol.

Molecular Properties

Compound Name2-[1-[(dipropylamino)methyl]cyclopropyl]ethanol
PubChem CID114757429
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name2-[1-[(dipropylamino)methyl]cyclopropyl]ethanol
SMILESCCCN(CCC)CC1(CCO)CC1
InChIInChI=1S/C12H25NO/c1-3-8-13(9-4-2)11-12(5-6-12)7-10-14/h14H,3-11H2,1-2H3
InChIKeyGSZKJYJFFVWSLL-UHFFFAOYSA-N
XLogP2.27
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[(dipropylamino)methyl]cyclopropyl]ethanol?
The IUPAC name of 2-[1-[(dipropylamino)methyl]cyclopropyl]ethanol (CID 114757429) is 2-[1-[(dipropylamino)methyl]cyclopropyl]ethanol.
What is the SMILES notation for 2-[1-[(dipropylamino)methyl]cyclopropyl]ethanol?
The canonical SMILES for 2-[1-[(dipropylamino)methyl]cyclopropyl]ethanol is CCCN(CCC)CC1(CCO)CC1.
What is the InChIKey of 2-[1-[(dipropylamino)methyl]cyclopropyl]ethanol?
The InChIKey is GSZKJYJFFVWSLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-3-8-13(9-4-2)11-12(5-6-12)7-10-14/h14H,3-11H2,1-2H3.
What are the key properties of 2-[1-[(dipropylamino)methyl]cyclopropyl]ethanol?
2-[1-[(dipropylamino)methyl]cyclopropyl]ethanol has a molecular weight of 199.34 g/mol, XLogP of 2.27, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(dipropylamino)methyl]cyclopropyl]ethanol is sourced from PubChem (CID 114757429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).