2-methyl-N-[[2-(2-methylpropyl)cyclopropyl]methyl]propan-1-amine

C12H25N — CID 62713714

IUPAC2-methyl-N-[[2-(2-methylpropyl)cyclopropyl]methyl]propan-1-amine
SMILESCC(C)CNCC1CC1CC(C)C
InChIInChI=1S/C12H25N/c1-9(2)5-11-6-12(11)8-13-7-10(3)4/h9-13H,5-8H2,1-4H3
InChIKeyGMJCGABLZXORAG-UHFFFAOYSA-N
MW183.34 g/mol
LogP2.91
Rot. Bonds6

About 2-methyl-N-[[2-(2-methylpropyl)cyclopropyl]methyl]propan-1-amine

2-methyl-N-[[2-(2-methylpropyl)cyclopropyl]methyl]propan-1-amine (PubChem CID 62713714) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is 2-methyl-N-[[2-(2-methylpropyl)cyclopropyl]methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[[2-(2-methylpropyl)cyclopropyl]methyl]propan-1-amine
PubChem CID62713714
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name2-methyl-N-[[2-(2-methylpropyl)cyclopropyl]methyl]propan-1-amine
SMILESCC(C)CNCC1CC1CC(C)C
InChIInChI=1S/C12H25N/c1-9(2)5-11-6-12(11)8-13-7-10(3)4/h9-13H,5-8H2,1-4H3
InChIKeyGMJCGABLZXORAG-UHFFFAOYSA-N
XLogP2.91
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[2-(2-methylpropyl)cyclopropyl]methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[[2-(2-methylpropyl)cyclopropyl]methyl]propan-1-amine (CID 62713714) is 2-methyl-N-[[2-(2-methylpropyl)cyclopropyl]methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[[2-(2-methylpropyl)cyclopropyl]methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[[2-(2-methylpropyl)cyclopropyl]methyl]propan-1-amine is CC(C)CNCC1CC1CC(C)C.
What is the InChIKey of 2-methyl-N-[[2-(2-methylpropyl)cyclopropyl]methyl]propan-1-amine?
The InChIKey is GMJCGABLZXORAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-9(2)5-11-6-12(11)8-13-7-10(3)4/h9-13H,5-8H2,1-4H3.
What are the key properties of 2-methyl-N-[[2-(2-methylpropyl)cyclopropyl]methyl]propan-1-amine?
2-methyl-N-[[2-(2-methylpropyl)cyclopropyl]methyl]propan-1-amine has a molecular weight of 183.34 g/mol, XLogP of 2.91, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[2-(2-methylpropyl)cyclopropyl]methyl]propan-1-amine is sourced from PubChem (CID 62713714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).