N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]cyclohexanamine

C14H28N2 — CID 79857362

IUPACN-[1-(aminomethyl)-2,2-dimethylcyclopentyl]cyclohexanamine
SMILESCC1(C)CCCC1(CN)NC1CCCCC1
InChIInChI=1S/C14H28N2/c1-13(2)9-6-10-14(13,11-15)16-12-7-4-3-5-8-12/h12,16H,3-11,15H2,1-2H3
InChIKeyRBVNXQKLPBAWCK-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.82
Rot. Bonds3

About N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]cyclohexanamine

N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]cyclohexanamine (PubChem CID 79857362) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]cyclohexanamine.

Molecular Properties

Compound NameN-[1-(aminomethyl)-2,2-dimethylcyclopentyl]cyclohexanamine
PubChem CID79857362
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC NameN-[1-(aminomethyl)-2,2-dimethylcyclopentyl]cyclohexanamine
SMILESCC1(C)CCCC1(CN)NC1CCCCC1
InChIInChI=1S/C14H28N2/c1-13(2)9-6-10-14(13,11-15)16-12-7-4-3-5-8-12/h12,16H,3-11,15H2,1-2H3
InChIKeyRBVNXQKLPBAWCK-UHFFFAOYSA-N
XLogP2.82
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]cyclohexanamine?
The IUPAC name of N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]cyclohexanamine (CID 79857362) is N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]cyclohexanamine.
What is the SMILES notation for N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]cyclohexanamine?
The canonical SMILES for N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]cyclohexanamine is CC1(C)CCCC1(CN)NC1CCCCC1.
What is the InChIKey of N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]cyclohexanamine?
The InChIKey is RBVNXQKLPBAWCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-13(2)9-6-10-14(13,11-15)16-12-7-4-3-5-8-12/h12,16H,3-11,15H2,1-2H3.
What are the key properties of N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]cyclohexanamine?
N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]cyclohexanamine has a molecular weight of 224.39 g/mol, XLogP of 2.82, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]cyclohexanamine is sourced from PubChem (CID 79857362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).