1-(1-aminoethyl)-N,N-dimethylcycloheptan-1-amine

C11H24N2 — CID 79081577

IUPAC1-(1-aminoethyl)-N,N-dimethylcycloheptan-1-amine
SMILESCC(N)C1(N(C)C)CCCCCC1
InChIInChI=1S/C11H24N2/c1-10(12)11(13(2)3)8-6-4-5-7-9-11/h10H,4-9,12H2,1-3H3
InChIKeyUNIUKBRUSMBZTD-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.99
Rot. Bonds2

About 1-(1-aminoethyl)-N,N-dimethylcycloheptan-1-amine

1-(1-aminoethyl)-N,N-dimethylcycloheptan-1-amine (PubChem CID 79081577) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is 1-(1-aminoethyl)-N,N-dimethylcycloheptan-1-amine.

Molecular Properties

Compound Name1-(1-aminoethyl)-N,N-dimethylcycloheptan-1-amine
PubChem CID79081577
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Name1-(1-aminoethyl)-N,N-dimethylcycloheptan-1-amine
SMILESCC(N)C1(N(C)C)CCCCCC1
InChIInChI=1S/C11H24N2/c1-10(12)11(13(2)3)8-6-4-5-7-9-11/h10H,4-9,12H2,1-3H3
InChIKeyUNIUKBRUSMBZTD-UHFFFAOYSA-N
XLogP1.99
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[amino(pyrimidin-5-yl)methyl]-N,N-dimethylcyclohexan-1-amine
CID 79066212
1-(1-amino-2,2-dimethylpropyl)-N,N-dimethylcycloheptan-1-amine
CID 79081680
1-(1-aminoprop-2-enyl)-N,N-dimethylcycloheptan-1-amine
CID 79081473
1-(1-amino-5-methylhexyl)-N,N-dimethylcyclohexan-1-amine
CID 83160951
1-(1-amino-3-methylbut-2-enyl)-N,N-dimethylcycloheptan-1-amine
CID 79178641
1-(1-aminopentyl)-N,N-dimethylcyclohexan-1-amine
CID 79066659
1-[amino(phenyl)methyl]-N,N-dimethylcyclohexan-1-amine
CID 59347798
1-(1-amino-2-cyclopentylethyl)-N,N-dimethylcycloheptan-1-amine
CID 79080652
1-(1-amino-3-methylbut-3-enyl)-N,N-dimethylcycloheptan-1-amine
CID 79185474
1-[amino-(3,5-dimethylphenyl)methyl]-N,N-dimethylcyclohexan-1-amine
CID 79065979
1-[amino-(2-methylphenyl)methyl]-N,N-dimethylcyclohexan-1-amine
CID 79066805
1-[amino(oxan-4-yl)methyl]-N,N-dimethylcyclohexan-1-amine
CID 79066285

Frequently Asked Questions

What is the IUPAC name of 1-(1-aminoethyl)-N,N-dimethylcycloheptan-1-amine?
The IUPAC name of 1-(1-aminoethyl)-N,N-dimethylcycloheptan-1-amine (CID 79081577) is 1-(1-aminoethyl)-N,N-dimethylcycloheptan-1-amine.
What is the SMILES notation for 1-(1-aminoethyl)-N,N-dimethylcycloheptan-1-amine?
The canonical SMILES for 1-(1-aminoethyl)-N,N-dimethylcycloheptan-1-amine is CC(N)C1(N(C)C)CCCCCC1.
What is the InChIKey of 1-(1-aminoethyl)-N,N-dimethylcycloheptan-1-amine?
The InChIKey is UNIUKBRUSMBZTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-10(12)11(13(2)3)8-6-4-5-7-9-11/h10H,4-9,12H2,1-3H3.
What are the key properties of 1-(1-aminoethyl)-N,N-dimethylcycloheptan-1-amine?
1-(1-aminoethyl)-N,N-dimethylcycloheptan-1-amine has a molecular weight of 184.33 g/mol, XLogP of 1.99, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-aminoethyl)-N,N-dimethylcycloheptan-1-amine is sourced from PubChem (CID 79081577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).