1-[2,3-dihydrofuran-5-yl(propylamino)methyl]-N,N-diethylcyclopentan-1-amine

C17H32N2O — CID 102651843

IUPAC1-[2,3-dihydrofuran-5-yl(propylamino)methyl]-N,N-diethylcyclopentan-1-amine
SMILESCCCNC(C1=CCCO1)C1(N(CC)CC)CCCC1
InChIInChI=1S/C17H32N2O/c1-4-13-18-16(15-10-9-14-20-15)17(11-7-8-12-17)19(5-2)6-3/h10,16,18H,4-9,11-14H2,1-3H3
InChIKeyNLIFOTCPGYPPMD-UHFFFAOYSA-N
MW280.46 g/mol
LogP3.31
Rot. Bonds8

About 1-[2,3-dihydrofuran-5-yl(propylamino)methyl]-N,N-diethylcyclopentan-1-amine

1-[2,3-dihydrofuran-5-yl(propylamino)methyl]-N,N-diethylcyclopentan-1-amine (PubChem CID 102651843) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 1-[2,3-dihydrofuran-5-yl(propylamino)methyl]-N,N-diethylcyclopentan-1-amine.

Molecular Properties

Compound Name1-[2,3-dihydrofuran-5-yl(propylamino)methyl]-N,N-diethylcyclopentan-1-amine
PubChem CID102651843
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name1-[2,3-dihydrofuran-5-yl(propylamino)methyl]-N,N-diethylcyclopentan-1-amine
SMILESCCCNC(C1=CCCO1)C1(N(CC)CC)CCCC1
InChIInChI=1S/C17H32N2O/c1-4-13-18-16(15-10-9-14-20-15)17(11-7-8-12-17)19(5-2)6-3/h10,16,18H,4-9,11-14H2,1-3H3
InChIKeyNLIFOTCPGYPPMD-UHFFFAOYSA-N
XLogP3.31
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2,3-dihydrofuran-5-yl(propylamino)methyl]-N,N-dimethylcyclohexan-1-amine
CID 102651857
1-[3,4-dihydro-2H-pyran-6-yl(propylamino)methyl]-N,N-dimethylcyclohexan-1-amine
CID 102647750
1-[2,3-dihydrofuran-5-yl(ethylamino)methyl]-N,N-dimethylcycloheptan-1-amine
CID 102651868
N,N-diethyl-1-[furan-3-yl(propylamino)methyl]cyclopentan-1-amine
CID 79070351
1-[2,3-dihydrofuran-5-yl(methylamino)methyl]-N,N-dimethylcyclohexan-1-amine
CID 102651855
N-[3,4-dihydro-2H-pyran-6-yl-(1-pyrrolidin-1-ylcyclopentyl)methyl]propan-1-amine
CID 102647740
N,N-diethyl-1-[propylamino(thiophen-3-yl)methyl]cyclopentan-1-amine
CID 79070431
N-[3,4-dihydro-2H-pyran-6-yl-(4-ethoxyoxan-4-yl)methyl]propan-1-amine
CID 102648125
N-[3,4-dihydro-2H-pyran-6-yl-(4-methoxyoxan-4-yl)methyl]propan-1-amine
CID 102648121
1-(2,3-dihydrofuran-5-yl)-N',N'-dimethyl-N-propylethane-1,2-diamine
CID 102651881
N,N-diethyl-1-[2-methyl-1-(propylamino)propyl]cyclopentan-1-amine
CID 79069888
N-[1-(2,3-dihydrofuran-5-yl)-2-(1-methoxycyclobutyl)ethyl]propan-1-amine
CID 103559989

Frequently Asked Questions

What is the IUPAC name of 1-[2,3-dihydrofuran-5-yl(propylamino)methyl]-N,N-diethylcyclopentan-1-amine?
The IUPAC name of 1-[2,3-dihydrofuran-5-yl(propylamino)methyl]-N,N-diethylcyclopentan-1-amine (CID 102651843) is 1-[2,3-dihydrofuran-5-yl(propylamino)methyl]-N,N-diethylcyclopentan-1-amine.
What is the SMILES notation for 1-[2,3-dihydrofuran-5-yl(propylamino)methyl]-N,N-diethylcyclopentan-1-amine?
The canonical SMILES for 1-[2,3-dihydrofuran-5-yl(propylamino)methyl]-N,N-diethylcyclopentan-1-amine is CCCNC(C1=CCCO1)C1(N(CC)CC)CCCC1.
What is the InChIKey of 1-[2,3-dihydrofuran-5-yl(propylamino)methyl]-N,N-diethylcyclopentan-1-amine?
The InChIKey is NLIFOTCPGYPPMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-4-13-18-16(15-10-9-14-20-15)17(11-7-8-12-17)19(5-2)6-3/h10,16,18H,4-9,11-14H2,1-3H3.
What are the key properties of 1-[2,3-dihydrofuran-5-yl(propylamino)methyl]-N,N-diethylcyclopentan-1-amine?
1-[2,3-dihydrofuran-5-yl(propylamino)methyl]-N,N-diethylcyclopentan-1-amine has a molecular weight of 280.46 g/mol, XLogP of 3.31, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2,3-dihydrofuran-5-yl(propylamino)methyl]-N,N-diethylcyclopentan-1-amine is sourced from PubChem (CID 102651843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).