2-[2-[2-methylpropyl(pentan-3-yl)amino]ethyl]cyclopentan-1-amine

C16H34N2 — CID 79565294

IUPAC2-[2-[2-methylpropyl(pentan-3-yl)amino]ethyl]cyclopentan-1-amine
SMILESCCC(CC)N(CCC1CCCC1N)CC(C)C
InChIInChI=1S/C16H34N2/c1-5-15(6-2)18(12-13(3)4)11-10-14-8-7-9-16(14)17/h13-16H,5-12,17H2,1-4H3
InChIKeyHXPFGJNBDVLYTN-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.65
Rot. Bonds8

About 2-[2-[2-methylpropyl(pentan-3-yl)amino]ethyl]cyclopentan-1-amine

2-[2-[2-methylpropyl(pentan-3-yl)amino]ethyl]cyclopentan-1-amine (PubChem CID 79565294) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 2-[2-[2-methylpropyl(pentan-3-yl)amino]ethyl]cyclopentan-1-amine.

Molecular Properties

Compound Name2-[2-[2-methylpropyl(pentan-3-yl)amino]ethyl]cyclopentan-1-amine
PubChem CID79565294
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC Name2-[2-[2-methylpropyl(pentan-3-yl)amino]ethyl]cyclopentan-1-amine
SMILESCCC(CC)N(CCC1CCCC1N)CC(C)C
InChIInChI=1S/C16H34N2/c1-5-15(6-2)18(12-13(3)4)11-10-14-8-7-9-16(14)17/h13-16H,5-12,17H2,1-4H3
InChIKeyHXPFGJNBDVLYTN-UHFFFAOYSA-N
XLogP3.65
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-[ethyl(propan-2-yl)amino]ethyl]cyclopentan-1-amine
CID 79569791
2-[2-[pentyl(propan-2-yl)amino]ethyl]cyclopentan-1-amine
CID 79565510
N-(2-methylpropyl)-N-(2-piperidin-4-ylethyl)pentan-3-amine
CID 79483878
N-[2-(azetidin-3-yl)ethyl]-N-(2-methylpropyl)pentan-3-amine
CID 116680240
4,4-dimethyl-2-[[2-methylpropyl(pentan-3-yl)amino]methyl]cyclohexan-1-amine
CID 79490016
2-(4-methylpentyl)cyclopentan-1-amine
CID 83158809
N,N-bis(2-methylpropyl)pentan-3-amine
CID 20735455
N-cyclohexyl-N'-(2-methylpropyl)-N'-pentan-3-ylethane-1,2-diamine
CID 79490778
2-[[butan-2-yl(ethyl)amino]methyl]cyclopentan-1-amine
CID 62614684
N-cyclopentyl-N'-(2-methylpropyl)-N'-pentan-3-ylpropane-1,3-diamine
CID 79490291
N'-[2-(2-aminocyclopentyl)ethyl]-N,N,N'-triethylpropane-1,3-diamine
CID 102992621
1-amino-4-[2-methylpropyl(pentan-3-yl)amino]butan-2-ol
CID 79489819

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-methylpropyl(pentan-3-yl)amino]ethyl]cyclopentan-1-amine?
The IUPAC name of 2-[2-[2-methylpropyl(pentan-3-yl)amino]ethyl]cyclopentan-1-amine (CID 79565294) is 2-[2-[2-methylpropyl(pentan-3-yl)amino]ethyl]cyclopentan-1-amine.
What is the SMILES notation for 2-[2-[2-methylpropyl(pentan-3-yl)amino]ethyl]cyclopentan-1-amine?
The canonical SMILES for 2-[2-[2-methylpropyl(pentan-3-yl)amino]ethyl]cyclopentan-1-amine is CCC(CC)N(CCC1CCCC1N)CC(C)C.
What is the InChIKey of 2-[2-[2-methylpropyl(pentan-3-yl)amino]ethyl]cyclopentan-1-amine?
The InChIKey is HXPFGJNBDVLYTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-5-15(6-2)18(12-13(3)4)11-10-14-8-7-9-16(14)17/h13-16H,5-12,17H2,1-4H3.
What are the key properties of 2-[2-[2-methylpropyl(pentan-3-yl)amino]ethyl]cyclopentan-1-amine?
2-[2-[2-methylpropyl(pentan-3-yl)amino]ethyl]cyclopentan-1-amine has a molecular weight of 254.46 g/mol, XLogP of 3.65, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-methylpropyl(pentan-3-yl)amino]ethyl]cyclopentan-1-amine is sourced from PubChem (CID 79565294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).