1-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclopentan-1-amine

C14H30N2O2 — CID 65044842

IUPAC1-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclopentan-1-amine
SMILESCOCCN(C(C)COC)C1(CN)CCCC1C
InChIInChI=1S/C14H30N2O2/c1-12-6-5-7-14(12,11-15)16(8-9-17-3)13(2)10-18-4/h12-13H,5-11,15H2,1-4H3
InChIKeyNKOTYLWHIDVHJA-UHFFFAOYSA-N
MW258.41 g/mol
LogP1.49
Rot. Bonds8

About 1-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclopentan-1-amine

1-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclopentan-1-amine (PubChem CID 65044842) has the molecular formula C14H30N2O2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 1-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclopentan-1-amine.

Molecular Properties

Compound Name1-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclopentan-1-amine
PubChem CID65044842
Molecular FormulaC14H30N2O2
Molecular Weight258.41 g/mol
Exact Mass258.23
IUPAC Name1-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclopentan-1-amine
SMILESCOCCN(C(C)COC)C1(CN)CCCC1C
InChIInChI=1S/C14H30N2O2/c1-12-6-5-7-14(12,11-15)16(8-9-17-3)13(2)10-18-4/h12-13H,5-11,15H2,1-4H3
InChIKeyNKOTYLWHIDVHJA-UHFFFAOYSA-N
XLogP1.49
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclopentan-1-amine?
The IUPAC name of 1-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclopentan-1-amine (CID 65044842) is 1-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclopentan-1-amine.
What is the SMILES notation for 1-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclopentan-1-amine?
The canonical SMILES for 1-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclopentan-1-amine is COCCN(C(C)COC)C1(CN)CCCC1C.
What is the InChIKey of 1-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclopentan-1-amine?
The InChIKey is NKOTYLWHIDVHJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-12-6-5-7-14(12,11-15)16(8-9-17-3)13(2)10-18-4/h12-13H,5-11,15H2,1-4H3.
What are the key properties of 1-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclopentan-1-amine?
1-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclopentan-1-amine has a molecular weight of 258.41 g/mol, XLogP of 1.49, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylcyclopentan-1-amine is sourced from PubChem (CID 65044842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).