1-(3,3-dimethylbutyl)-N-methylcyclopropan-1-amine

C10H21N — CID 83682072

IUPAC1-(3,3-dimethylbutyl)-N-methylcyclopropan-1-amine
SMILESCNC1(CCC(C)(C)C)CC1
InChIInChI=1S/C10H21N/c1-9(2,3)5-6-10(11-4)7-8-10/h11H,5-8H2,1-4H3
InChIKeyFALXBTXNJFXIJA-UHFFFAOYSA-N
MW155.28 g/mol
LogP2.56
Rot. Bonds3

About 1-(3,3-dimethylbutyl)-N-methylcyclopropan-1-amine

1-(3,3-dimethylbutyl)-N-methylcyclopropan-1-amine (PubChem CID 83682072) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is 1-(3,3-dimethylbutyl)-N-methylcyclopropan-1-amine.

Molecular Properties

Compound Name1-(3,3-dimethylbutyl)-N-methylcyclopropan-1-amine
PubChem CID83682072
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name1-(3,3-dimethylbutyl)-N-methylcyclopropan-1-amine
SMILESCNC1(CCC(C)(C)C)CC1
InChIInChI=1S/C10H21N/c1-9(2,3)5-6-10(11-4)7-8-10/h11H,5-8H2,1-4H3
InChIKeyFALXBTXNJFXIJA-UHFFFAOYSA-N
XLogP2.56
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 ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(3,3-dimethylbutyl)-N-methylcyclopropan-1-amine?
The IUPAC name of 1-(3,3-dimethylbutyl)-N-methylcyclopropan-1-amine (CID 83682072) is 1-(3,3-dimethylbutyl)-N-methylcyclopropan-1-amine.
What is the SMILES notation for 1-(3,3-dimethylbutyl)-N-methylcyclopropan-1-amine?
The canonical SMILES for 1-(3,3-dimethylbutyl)-N-methylcyclopropan-1-amine is CNC1(CCC(C)(C)C)CC1.
What is the InChIKey of 1-(3,3-dimethylbutyl)-N-methylcyclopropan-1-amine?
The InChIKey is FALXBTXNJFXIJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-9(2,3)5-6-10(11-4)7-8-10/h11H,5-8H2,1-4H3.
What are the key properties of 1-(3,3-dimethylbutyl)-N-methylcyclopropan-1-amine?
1-(3,3-dimethylbutyl)-N-methylcyclopropan-1-amine has a molecular weight of 155.28 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,3-dimethylbutyl)-N-methylcyclopropan-1-amine is sourced from PubChem (CID 83682072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).