2-methyl-N-[(2-quinolin-6-ylcyclopropyl)methyl]propan-1-amine

C17H22N2 — CID 63971053

IUPAC2-methyl-N-[(2-quinolin-6-ylcyclopropyl)methyl]propan-1-amine
SMILESCC(C)CNCC1CC1c1ccc2ncccc2c1
InChIInChI=1S/C17H22N2/c1-12(2)10-18-11-15-9-16(15)13-5-6-17-14(8-13)4-3-7-19-17/h3-8,12,15-16,18H,9-11H2,1-2H3
InChIKeyICFIFZPYHZKTNF-UHFFFAOYSA-N
MW254.38 g/mol
LogP3.58
Rot. Bonds5

About 2-methyl-N-[(2-quinolin-6-ylcyclopropyl)methyl]propan-1-amine

2-methyl-N-[(2-quinolin-6-ylcyclopropyl)methyl]propan-1-amine (PubChem CID 63971053) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is 2-methyl-N-[(2-quinolin-6-ylcyclopropyl)methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[(2-quinolin-6-ylcyclopropyl)methyl]propan-1-amine
PubChem CID63971053
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC Name2-methyl-N-[(2-quinolin-6-ylcyclopropyl)methyl]propan-1-amine
SMILESCC(C)CNCC1CC1c1ccc2ncccc2c1
InChIInChI=1S/C17H22N2/c1-12(2)10-18-11-15-9-16(15)13-5-6-17-14(8-13)4-3-7-19-17/h3-8,12,15-16,18H,9-11H2,1-2H3
InChIKeyICFIFZPYHZKTNF-UHFFFAOYSA-N
XLogP3.58
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(2-quinolin-6-ylcyclopropyl)methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[(2-quinolin-6-ylcyclopropyl)methyl]propan-1-amine (CID 63971053) is 2-methyl-N-[(2-quinolin-6-ylcyclopropyl)methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[(2-quinolin-6-ylcyclopropyl)methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[(2-quinolin-6-ylcyclopropyl)methyl]propan-1-amine is CC(C)CNCC1CC1c1ccc2ncccc2c1.
What is the InChIKey of 2-methyl-N-[(2-quinolin-6-ylcyclopropyl)methyl]propan-1-amine?
The InChIKey is ICFIFZPYHZKTNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c1-12(2)10-18-11-15-9-16(15)13-5-6-17-14(8-13)4-3-7-19-17/h3-8,12,15-16,18H,9-11H2,1-2H3.
What are the key properties of 2-methyl-N-[(2-quinolin-6-ylcyclopropyl)methyl]propan-1-amine?
2-methyl-N-[(2-quinolin-6-ylcyclopropyl)methyl]propan-1-amine has a molecular weight of 254.38 g/mol, XLogP of 3.58, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(2-quinolin-6-ylcyclopropyl)methyl]propan-1-amine is sourced from PubChem (CID 63971053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).