1-(1-ethylcyclopentyl)-3-(oxolan-2-yl)propan-1-amine

C14H27NO — CID 104993713

IUPAC1-(1-ethylcyclopentyl)-3-(oxolan-2-yl)propan-1-amine
SMILESCCC1(C(N)CCC2CCCO2)CCCC1
InChIInChI=1S/C14H27NO/c1-2-14(9-3-4-10-14)13(15)8-7-12-6-5-11-16-12/h12-13H,2-11,15H2,1H3
InChIKeyDDTVICCMPCPNSE-UHFFFAOYSA-N
MW225.38 g/mol
LogP3.24
Rot. Bonds5

About 1-(1-ethylcyclopentyl)-3-(oxolan-2-yl)propan-1-amine

1-(1-ethylcyclopentyl)-3-(oxolan-2-yl)propan-1-amine (PubChem CID 104993713) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 1-(1-ethylcyclopentyl)-3-(oxolan-2-yl)propan-1-amine.

Molecular Properties

Compound Name1-(1-ethylcyclopentyl)-3-(oxolan-2-yl)propan-1-amine
PubChem CID104993713
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name1-(1-ethylcyclopentyl)-3-(oxolan-2-yl)propan-1-amine
SMILESCCC1(C(N)CCC2CCCO2)CCCC1
InChIInChI=1S/C14H27NO/c1-2-14(9-3-4-10-14)13(15)8-7-12-6-5-11-16-12/h12-13H,2-11,15H2,1H3
InChIKeyDDTVICCMPCPNSE-UHFFFAOYSA-N
XLogP3.24
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(oxolan-2-yl)pentan-3-amine
CID 62549637
1-(4-methoxyoxan-4-yl)-3-(oxolan-2-yl)propan-1-amine
CID 116764425
1-(1-ethoxy-4,4-dimethylcyclohexyl)-3-(oxolan-2-yl)propan-1-amine
CID 116768621
(2R)-4-[(2R)-oxolan-2-yl]butan-2-amine
CID 7380763
1,5-bis(oxolan-2-yl)pentan-3-amine
CID 104993652
3-(oxolan-2-yl)-1-(1-phenylcyclohexyl)propan-1-amine
CID 65164463
N-ethyl-1-[1-(2-methylpropyl)cyclopentyl]-3-(oxolan-2-yl)propan-1-amine
CID 104993519
N-methyl-1-(1-methylcyclohexyl)-3-(oxolan-2-yl)propan-1-amine
CID 106830218
1-(2-methyloxan-2-yl)-4-(oxolan-2-yl)butan-1-amine
CID 80683820
4-methyl-1-(oxolan-2-yl)heptan-3-amine
CID 104993629
1-methylsulfanyl-4-(oxolan-2-yl)butan-2-amine
CID 65164455
4-methyl-3-[2-(oxolan-2-yl)ethyl]pentan-2-amine
CID 65161981

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylcyclopentyl)-3-(oxolan-2-yl)propan-1-amine?
The IUPAC name of 1-(1-ethylcyclopentyl)-3-(oxolan-2-yl)propan-1-amine (CID 104993713) is 1-(1-ethylcyclopentyl)-3-(oxolan-2-yl)propan-1-amine.
What is the SMILES notation for 1-(1-ethylcyclopentyl)-3-(oxolan-2-yl)propan-1-amine?
The canonical SMILES for 1-(1-ethylcyclopentyl)-3-(oxolan-2-yl)propan-1-amine is CCC1(C(N)CCC2CCCO2)CCCC1.
What is the InChIKey of 1-(1-ethylcyclopentyl)-3-(oxolan-2-yl)propan-1-amine?
The InChIKey is DDTVICCMPCPNSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-2-14(9-3-4-10-14)13(15)8-7-12-6-5-11-16-12/h12-13H,2-11,15H2,1H3.
What are the key properties of 1-(1-ethylcyclopentyl)-3-(oxolan-2-yl)propan-1-amine?
1-(1-ethylcyclopentyl)-3-(oxolan-2-yl)propan-1-amine has a molecular weight of 225.38 g/mol, XLogP of 3.24, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylcyclopentyl)-3-(oxolan-2-yl)propan-1-amine is sourced from PubChem (CID 104993713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).