(2,7-dimethylcycloheptyl)methanamine

C10H21N — CID 83905212

IUPAC(2,7-dimethylcycloheptyl)methanamine
SMILESCC1CCCCC(C)C1CN
InChIInChI=1S/C10H21N/c1-8-5-3-4-6-9(2)10(8)7-11/h8-10H,3-7,11H2,1-2H3
InChIKeyAHVYMAPFZUCLSU-UHFFFAOYSA-N
MW155.29 g/mol
LogP2.41
Rot. Bonds1

About (2,7-dimethylcycloheptyl)methanamine

(2,7-dimethylcycloheptyl)methanamine (PubChem CID 83905212) has the molecular formula C10H21N and a molecular weight of 155.29 g/mol. Its IUPAC name is (2,7-dimethylcycloheptyl)methanamine.

Molecular Properties

Compound Name(2,7-dimethylcycloheptyl)methanamine
PubChem CID83905212
Molecular FormulaC10H21N
Molecular Weight155.29 g/mol
Exact Mass155.17
IUPAC Name(2,7-dimethylcycloheptyl)methanamine
SMILESCC1CCCCC(C)C1CN
InChIInChI=1S/C10H21N/c1-8-5-3-4-6-9(2)10(8)7-11/h8-10H,3-7,11H2,1-2H3
InChIKeyAHVYMAPFZUCLSU-UHFFFAOYSA-N
XLogP2.41
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.29
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2,7-dimethylcycloheptyl)methanamine?
The IUPAC name of (2,7-dimethylcycloheptyl)methanamine (CID 83905212) is (2,7-dimethylcycloheptyl)methanamine.
What is the SMILES notation for (2,7-dimethylcycloheptyl)methanamine?
The canonical SMILES for (2,7-dimethylcycloheptyl)methanamine is CC1CCCCC(C)C1CN.
What is the InChIKey of (2,7-dimethylcycloheptyl)methanamine?
The InChIKey is AHVYMAPFZUCLSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-8-5-3-4-6-9(2)10(8)7-11/h8-10H,3-7,11H2,1-2H3.
What are the key properties of (2,7-dimethylcycloheptyl)methanamine?
(2,7-dimethylcycloheptyl)methanamine has a molecular weight of 155.29 g/mol, XLogP of 2.41, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,7-dimethylcycloheptyl)methanamine is sourced from PubChem (CID 83905212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).