N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine;hydrochloride

C9H20ClN — CID 117274302

IUPACN-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine;hydrochloride
SMILESCNCC1C(C)(C)C1(C)C.Cl
InChIInChI=1S/C9H19N.ClH/c1-8(2)7(6-10-5)9(8,3)4;/h7,10H,6H2,1-5H3;1H
InChIKeyMQFCLLXAPRGVFK-UHFFFAOYSA-N
MW177.72 g/mol
LogP2.31
Rot. Bonds2

About N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine;hydrochloride

N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine;hydrochloride (PubChem CID 117274302) has the molecular formula C9H20ClN and a molecular weight of 177.72 g/mol. Its IUPAC name is N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine;hydrochloride.

Molecular Properties

Compound NameN-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine;hydrochloride
PubChem CID117274302
Molecular FormulaC9H20ClN
Molecular Weight177.72 g/mol
Exact Mass177.13
IUPAC NameN-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine;hydrochloride
SMILESCNCC1C(C)(C)C1(C)C.Cl
InChIInChI=1S/C9H19N.ClH/c1-8(2)7(6-10-5)9(8,3)4;/h7,10H,6H2,1-5H3;1H
InChIKeyMQFCLLXAPRGVFK-UHFFFAOYSA-N
XLogP2.31
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.72
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine;hydrochloride?
The IUPAC name of N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine;hydrochloride (CID 117274302) is N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine;hydrochloride.
What is the SMILES notation for N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine;hydrochloride?
The canonical SMILES for N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine;hydrochloride is CNCC1C(C)(C)C1(C)C.Cl.
What is the InChIKey of N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine;hydrochloride?
The InChIKey is MQFCLLXAPRGVFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N.ClH/c1-8(2)7(6-10-5)9(8,3)4;/h7,10H,6H2,1-5H3;1H.
What are the key properties of N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine;hydrochloride?
N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine;hydrochloride has a molecular weight of 177.72 g/mol, XLogP of 2.31, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2,2,3,3-tetramethylcyclopropyl)methanamine;hydrochloride is sourced from PubChem (CID 117274302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).