2-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methylcyclopentan-1-amine

C14H30N2O — CID 82767325

IUPAC2-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methylcyclopentan-1-amine
SMILESCCC(C)N(CCOC)CC1(C)CCCC1N
InChIInChI=1S/C14H30N2O/c1-5-12(2)16(9-10-17-4)11-14(3)8-6-7-13(14)15/h12-13H,5-11,15H2,1-4H3
InChIKeyJWRQKEXAXJHZFE-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.25
Rot. Bonds7

About 2-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methylcyclopentan-1-amine

2-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methylcyclopentan-1-amine (PubChem CID 82767325) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 2-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methylcyclopentan-1-amine.

Molecular Properties

Compound Name2-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methylcyclopentan-1-amine
PubChem CID82767325
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name2-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methylcyclopentan-1-amine
SMILESCCC(C)N(CCOC)CC1(C)CCCC1N
InChIInChI=1S/C14H30N2O/c1-5-12(2)16(9-10-17-4)11-14(3)8-6-7-13(14)15/h12-13H,5-11,15H2,1-4H3
InChIKeyJWRQKEXAXJHZFE-UHFFFAOYSA-N
XLogP2.25
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methylcyclopentan-1-amine with MolForge

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Related Compounds

2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2-methylcyclopentan-1-amine
CID 82767668
2-methyl-2-[[methyl(3-methylbutyl)amino]methyl]cyclopentan-1-amine
CID 82767754
N-(2-methoxyethyl)-N-[[1-[(propan-2-ylamino)methyl]cyclohexyl]methyl]butan-2-amine
CID 62260342
4-[[2-methoxyethyl(propan-2-yl)amino]methyl]-4-methyloxolan-3-amine
CID 82951489
2-[[cyclobutylmethyl(methyl)amino]methyl]-2-methylcyclopentan-1-amine
CID 82768295
2-N-(2-methoxyethyl)-2-N-pentan-3-ylcyclooctane-1,2-diamine
CID 55004362
1-(aminomethyl)-N-butan-2-yl-N-(2-methoxyethyl)-4-propylcycloheptan-1-amine
CID 65088706
ethyl 1-amino-2-[2-[2-methoxyethyl(propan-2-yl)amino]ethyl]cyclopentane-1-carboxylate
CID 82941282
N-(2-methoxyethyl)-N-[(3-propylpiperidin-3-yl)methyl]butan-2-amine
CID 55164134
(2S)-1-[butan-2-yl(2-methoxyethyl)amino]propan-2-ol
CID 103935046
5-[[2-methoxyethyl(1-methoxypropan-2-yl)amino]methyl]-2,2-dimethylcyclopentan-1-amine
CID 79855167
1-(aminomethyl)-N-butan-2-yl-N-(2-methoxyethyl)-3-(trifluoromethyl)cyclohexan-1-amine
CID 64757009

Frequently Asked Questions

What is the IUPAC name of 2-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methylcyclopentan-1-amine?
The IUPAC name of 2-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methylcyclopentan-1-amine (CID 82767325) is 2-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methylcyclopentan-1-amine.
What is the SMILES notation for 2-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methylcyclopentan-1-amine?
The canonical SMILES for 2-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methylcyclopentan-1-amine is CCC(C)N(CCOC)CC1(C)CCCC1N.
What is the InChIKey of 2-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methylcyclopentan-1-amine?
The InChIKey is JWRQKEXAXJHZFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-5-12(2)16(9-10-17-4)11-14(3)8-6-7-13(14)15/h12-13H,5-11,15H2,1-4H3.
What are the key properties of 2-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methylcyclopentan-1-amine?
2-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methylcyclopentan-1-amine has a molecular weight of 242.41 g/mol, XLogP of 2.25, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[butan-2-yl(2-methoxyethyl)amino]methyl]-2-methylcyclopentan-1-amine is sourced from PubChem (CID 82767325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).