N-[1-(aminomethyl)-3-methylcyclopentyl]-N-methylcyclohexanamine

C14H28N2 — CID 64501146

IUPACN-[1-(aminomethyl)-3-methylcyclopentyl]-N-methylcyclohexanamine
SMILESCC1CCC(CN)(N(C)C2CCCCC2)C1
InChIInChI=1S/C14H28N2/c1-12-8-9-14(10-12,11-15)16(2)13-6-4-3-5-7-13/h12-13H,3-11,15H2,1-2H3
InChIKeyVQJUBKHJFKMVBZ-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.77
Rot. Bonds3

About N-[1-(aminomethyl)-3-methylcyclopentyl]-N-methylcyclohexanamine

N-[1-(aminomethyl)-3-methylcyclopentyl]-N-methylcyclohexanamine (PubChem CID 64501146) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is N-[1-(aminomethyl)-3-methylcyclopentyl]-N-methylcyclohexanamine.

Molecular Properties

Compound NameN-[1-(aminomethyl)-3-methylcyclopentyl]-N-methylcyclohexanamine
PubChem CID64501146
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC NameN-[1-(aminomethyl)-3-methylcyclopentyl]-N-methylcyclohexanamine
SMILESCC1CCC(CN)(N(C)C2CCCCC2)C1
InChIInChI=1S/C14H28N2/c1-12-8-9-14(10-12,11-15)16(2)13-6-4-3-5-7-13/h12-13H,3-11,15H2,1-2H3
InChIKeyVQJUBKHJFKMVBZ-UHFFFAOYSA-N
XLogP2.77
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)-3-methylcyclopentyl]-N-methylcyclohexanamine?
The IUPAC name of N-[1-(aminomethyl)-3-methylcyclopentyl]-N-methylcyclohexanamine (CID 64501146) is N-[1-(aminomethyl)-3-methylcyclopentyl]-N-methylcyclohexanamine.
What is the SMILES notation for N-[1-(aminomethyl)-3-methylcyclopentyl]-N-methylcyclohexanamine?
The canonical SMILES for N-[1-(aminomethyl)-3-methylcyclopentyl]-N-methylcyclohexanamine is CC1CCC(CN)(N(C)C2CCCCC2)C1.
What is the InChIKey of N-[1-(aminomethyl)-3-methylcyclopentyl]-N-methylcyclohexanamine?
The InChIKey is VQJUBKHJFKMVBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-12-8-9-14(10-12,11-15)16(2)13-6-4-3-5-7-13/h12-13H,3-11,15H2,1-2H3.
What are the key properties of N-[1-(aminomethyl)-3-methylcyclopentyl]-N-methylcyclohexanamine?
N-[1-(aminomethyl)-3-methylcyclopentyl]-N-methylcyclohexanamine has a molecular weight of 224.39 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)-3-methylcyclopentyl]-N-methylcyclohexanamine is sourced from PubChem (CID 64501146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).