ethane;3-(ethylamino)-4-methylpentan-1-ol

C10H25NO — CID 171660541

IUPACethane;3-(ethylamino)-4-methylpentan-1-ol
SMILESCC.CCNC(CCO)C(C)C
InChIInChI=1S/C8H19NO.C2H6/c1-4-9-8(5-6-10)7(2)3;1-2/h7-10H,4-6H2,1-3H3;1-2H3
InChIKeyDKDBVISBROGXKM-UHFFFAOYSA-N
MW175.32 g/mol
LogP2.03
Rot. Bonds5

About ethane;3-(ethylamino)-4-methylpentan-1-ol

ethane;3-(ethylamino)-4-methylpentan-1-ol (PubChem CID 171660541) has the molecular formula C10H25NO and a molecular weight of 175.32 g/mol. Its IUPAC name is ethane;3-(ethylamino)-4-methylpentan-1-ol.

Molecular Properties

Compound Nameethane;3-(ethylamino)-4-methylpentan-1-ol
PubChem CID171660541
Molecular FormulaC10H25NO
Molecular Weight175.32 g/mol
Exact Mass175.19
IUPAC Nameethane;3-(ethylamino)-4-methylpentan-1-ol
SMILESCC.CCNC(CCO)C(C)C
InChIInChI=1S/C8H19NO.C2H6/c1-4-9-8(5-6-10)7(2)3;1-2/h7-10H,4-6H2,1-3H3;1-2H3
InChIKeyDKDBVISBROGXKM-UHFFFAOYSA-N
XLogP2.03
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.32
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;3-(ethylamino)-4-methylpentan-1-ol?
The IUPAC name of ethane;3-(ethylamino)-4-methylpentan-1-ol (CID 171660541) is ethane;3-(ethylamino)-4-methylpentan-1-ol.
What is the SMILES notation for ethane;3-(ethylamino)-4-methylpentan-1-ol?
The canonical SMILES for ethane;3-(ethylamino)-4-methylpentan-1-ol is CC.CCNC(CCO)C(C)C.
What is the InChIKey of ethane;3-(ethylamino)-4-methylpentan-1-ol?
The InChIKey is DKDBVISBROGXKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO.C2H6/c1-4-9-8(5-6-10)7(2)3;1-2/h7-10H,4-6H2,1-3H3;1-2H3.
What are the key properties of ethane;3-(ethylamino)-4-methylpentan-1-ol?
ethane;3-(ethylamino)-4-methylpentan-1-ol has a molecular weight of 175.32 g/mol, XLogP of 2.03, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-(ethylamino)-4-methylpentan-1-ol is sourced from PubChem (CID 171660541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).