N-[(3,3-dimethylcyclopentyl)methyl]ethanamine

C10H21N — CID 80705004

IUPACN-[(3,3-dimethylcyclopentyl)methyl]ethanamine
SMILESCCNCC1CCC(C)(C)C1
InChIInChI=1S/C10H21N/c1-4-11-8-9-5-6-10(2,3)7-9/h9,11H,4-8H2,1-3H3
InChIKeyCBYYFWBZRDSZQZ-UHFFFAOYSA-N
MW155.28 g/mol
LogP2.42
Rot. Bonds3

About N-[(3,3-dimethylcyclopentyl)methyl]ethanamine

N-[(3,3-dimethylcyclopentyl)methyl]ethanamine (PubChem CID 80705004) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is N-[(3,3-dimethylcyclopentyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(3,3-dimethylcyclopentyl)methyl]ethanamine
PubChem CID80705004
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC NameN-[(3,3-dimethylcyclopentyl)methyl]ethanamine
SMILESCCNCC1CCC(C)(C)C1
InChIInChI=1S/C10H21N/c1-4-11-8-9-5-6-10(2,3)7-9/h9,11H,4-8H2,1-3H3
InChIKeyCBYYFWBZRDSZQZ-UHFFFAOYSA-N
XLogP2.42
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[(3,3-dimethylcyclopentyl)methyl]ethanamine?
The IUPAC name of N-[(3,3-dimethylcyclopentyl)methyl]ethanamine (CID 80705004) is N-[(3,3-dimethylcyclopentyl)methyl]ethanamine.
What is the SMILES notation for N-[(3,3-dimethylcyclopentyl)methyl]ethanamine?
The canonical SMILES for N-[(3,3-dimethylcyclopentyl)methyl]ethanamine is CCNCC1CCC(C)(C)C1.
What is the InChIKey of N-[(3,3-dimethylcyclopentyl)methyl]ethanamine?
The InChIKey is CBYYFWBZRDSZQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-4-11-8-9-5-6-10(2,3)7-9/h9,11H,4-8H2,1-3H3.
What are the key properties of N-[(3,3-dimethylcyclopentyl)methyl]ethanamine?
N-[(3,3-dimethylcyclopentyl)methyl]ethanamine has a molecular weight of 155.28 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,3-dimethylcyclopentyl)methyl]ethanamine is sourced from PubChem (CID 80705004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).