1-cycloheptyl-N-methyl-1-(1-methylcyclopropyl)methanamine

C13H25N — CID 82931631

IUPAC1-cycloheptyl-N-methyl-1-(1-methylcyclopropyl)methanamine
SMILESCNC(C1CCCCCC1)C1(C)CC1
InChIInChI=1S/C13H25N/c1-13(9-10-13)12(14-2)11-7-5-3-4-6-8-11/h11-12,14H,3-10H2,1-2H3
InChIKeyWUUKODYUGWTIOL-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.34
Rot. Bonds3

About 1-cycloheptyl-N-methyl-1-(1-methylcyclopropyl)methanamine

1-cycloheptyl-N-methyl-1-(1-methylcyclopropyl)methanamine (PubChem CID 82931631) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is 1-cycloheptyl-N-methyl-1-(1-methylcyclopropyl)methanamine.

Molecular Properties

Compound Name1-cycloheptyl-N-methyl-1-(1-methylcyclopropyl)methanamine
PubChem CID82931631
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Name1-cycloheptyl-N-methyl-1-(1-methylcyclopropyl)methanamine
SMILESCNC(C1CCCCCC1)C1(C)CC1
InChIInChI=1S/C13H25N/c1-13(9-10-13)12(14-2)11-7-5-3-4-6-8-11/h11-12,14H,3-10H2,1-2H3
InChIKeyWUUKODYUGWTIOL-UHFFFAOYSA-N
XLogP3.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-cycloheptyl-N-methyl-1-(1-methylcyclopropyl)methanamine?
The IUPAC name of 1-cycloheptyl-N-methyl-1-(1-methylcyclopropyl)methanamine (CID 82931631) is 1-cycloheptyl-N-methyl-1-(1-methylcyclopropyl)methanamine.
What is the SMILES notation for 1-cycloheptyl-N-methyl-1-(1-methylcyclopropyl)methanamine?
The canonical SMILES for 1-cycloheptyl-N-methyl-1-(1-methylcyclopropyl)methanamine is CNC(C1CCCCCC1)C1(C)CC1.
What is the InChIKey of 1-cycloheptyl-N-methyl-1-(1-methylcyclopropyl)methanamine?
The InChIKey is WUUKODYUGWTIOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-13(9-10-13)12(14-2)11-7-5-3-4-6-8-11/h11-12,14H,3-10H2,1-2H3.
What are the key properties of 1-cycloheptyl-N-methyl-1-(1-methylcyclopropyl)methanamine?
1-cycloheptyl-N-methyl-1-(1-methylcyclopropyl)methanamine has a molecular weight of 195.35 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cycloheptyl-N-methyl-1-(1-methylcyclopropyl)methanamine is sourced from PubChem (CID 82931631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).