N-ethyl-1-(oxan-3-yl)pentan-1-amine

C12H25NO — CID 65331760

IUPACN-ethyl-1-(oxan-3-yl)pentan-1-amine
SMILESCCCCC(NCC)C1CCCOC1
InChIInChI=1S/C12H25NO/c1-3-5-8-12(13-4-2)11-7-6-9-14-10-11/h11-13H,3-10H2,1-2H3
InChIKeyBLNQAVGGNWZMFO-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.58
Rot. Bonds6

About N-ethyl-1-(oxan-3-yl)pentan-1-amine

N-ethyl-1-(oxan-3-yl)pentan-1-amine (PubChem CID 65331760) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is N-ethyl-1-(oxan-3-yl)pentan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-(oxan-3-yl)pentan-1-amine
PubChem CID65331760
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC NameN-ethyl-1-(oxan-3-yl)pentan-1-amine
SMILESCCCCC(NCC)C1CCCOC1
InChIInChI=1S/C12H25NO/c1-3-5-8-12(13-4-2)11-7-6-9-14-10-11/h11-13H,3-10H2,1-2H3
InChIKeyBLNQAVGGNWZMFO-UHFFFAOYSA-N
XLogP2.58
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-(oxolan-3-yl)pentan-1-amine
CID 65330630
3-(ethylamino)-3-(oxan-3-yl)propan-1-ol
CID 65239845
1-(oxan-3-yl)-N-propyldecan-1-amine
CID 65332318
N-ethyl-1-(oxan-3-yl)-3-propoxypropan-1-amine
CID 107138944
3-ethoxy-N-ethyl-1-(oxan-3-yl)propan-1-amine
CID 107137018
N-ethyl-1-(oxan-3-yl)-2-(oxan-4-yl)ethanamine
CID 65331868
5,5,5-trifluoro-1-(oxan-3-yl)-N-propylpentan-1-amine
CID 113327066
4-methylsulfonyl-1-(oxan-3-yl)-N-propylbutan-1-amine
CID 65333768
1-(oxan-3-yl)-4-(oxolan-2-yl)-N-propylbutan-1-amine
CID 65333769
1-cyclobutyl-N-ethylundecan-1-amine
CID 64986983
N-ethyl-3-methoxy-3-methyl-1-(oxan-3-yl)butan-1-amine
CID 107138800
[3-ethyl-1-(oxan-3-yl)heptyl]hydrazine
CID 105229896

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(oxan-3-yl)pentan-1-amine?
The IUPAC name of N-ethyl-1-(oxan-3-yl)pentan-1-amine (CID 65331760) is N-ethyl-1-(oxan-3-yl)pentan-1-amine.
What is the SMILES notation for N-ethyl-1-(oxan-3-yl)pentan-1-amine?
The canonical SMILES for N-ethyl-1-(oxan-3-yl)pentan-1-amine is CCCCC(NCC)C1CCCOC1.
What is the InChIKey of N-ethyl-1-(oxan-3-yl)pentan-1-amine?
The InChIKey is BLNQAVGGNWZMFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-3-5-8-12(13-4-2)11-7-6-9-14-10-11/h11-13H,3-10H2,1-2H3.
What are the key properties of N-ethyl-1-(oxan-3-yl)pentan-1-amine?
N-ethyl-1-(oxan-3-yl)pentan-1-amine has a molecular weight of 199.34 g/mol, XLogP of 2.58, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(oxan-3-yl)pentan-1-amine is sourced from PubChem (CID 65331760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).