N-methyl-1-[(2R)-2-methyl-2-(4-methylphenyl)cyclopropyl]methanamine

C13H19N — CID 143290499

IUPACN-methyl-1-[(2R)-2-methyl-2-(4-methylphenyl)cyclopropyl]methanamine
SMILESCNCC1C[C@@]1(C)c1ccc(C)cc1
InChIInChI=1S/C13H19N/c1-10-4-6-11(7-5-10)13(2)8-12(13)9-14-3/h4-7,12,14H,8-9H2,1-3H3/t12?,13-/m0/s1
InChIKeyPKSCIUMUTWXFHT-ABLWVSNPSA-N
MW189.30 g/mol
LogP2.49
Rot. Bonds3

About N-methyl-1-[(2R)-2-methyl-2-(4-methylphenyl)cyclopropyl]methanamine

N-methyl-1-[(2R)-2-methyl-2-(4-methylphenyl)cyclopropyl]methanamine (PubChem CID 143290499) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is N-methyl-1-[(2R)-2-methyl-2-(4-methylphenyl)cyclopropyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[(2R)-2-methyl-2-(4-methylphenyl)cyclopropyl]methanamine
PubChem CID143290499
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC NameN-methyl-1-[(2R)-2-methyl-2-(4-methylphenyl)cyclopropyl]methanamine
SMILESCNCC1C[C@@]1(C)c1ccc(C)cc1
InChIInChI=1S/C13H19N/c1-10-4-6-11(7-5-10)13(2)8-12(13)9-14-3/h4-7,12,14H,8-9H2,1-3H3/t12?,13-/m0/s1
InChIKeyPKSCIUMUTWXFHT-ABLWVSNPSA-N
XLogP2.49
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[(2R)-2-methyl-2-(4-methylphenyl)cyclopropyl]methanamine?
The IUPAC name of N-methyl-1-[(2R)-2-methyl-2-(4-methylphenyl)cyclopropyl]methanamine (CID 143290499) is N-methyl-1-[(2R)-2-methyl-2-(4-methylphenyl)cyclopropyl]methanamine.
What is the SMILES notation for N-methyl-1-[(2R)-2-methyl-2-(4-methylphenyl)cyclopropyl]methanamine?
The canonical SMILES for N-methyl-1-[(2R)-2-methyl-2-(4-methylphenyl)cyclopropyl]methanamine is CNCC1C[C@@]1(C)c1ccc(C)cc1.
What is the InChIKey of N-methyl-1-[(2R)-2-methyl-2-(4-methylphenyl)cyclopropyl]methanamine?
The InChIKey is PKSCIUMUTWXFHT-ABLWVSNPSA-N. The full InChI is InChI=1S/C13H19N/c1-10-4-6-11(7-5-10)13(2)8-12(13)9-14-3/h4-7,12,14H,8-9H2,1-3H3/t12?,13-/m0/s1.
What are the key properties of N-methyl-1-[(2R)-2-methyl-2-(4-methylphenyl)cyclopropyl]methanamine?
N-methyl-1-[(2R)-2-methyl-2-(4-methylphenyl)cyclopropyl]methanamine has a molecular weight of 189.30 g/mol, XLogP of 2.49, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[(2R)-2-methyl-2-(4-methylphenyl)cyclopropyl]methanamine is sourced from PubChem (CID 143290499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).