1-cyclopropyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine

C13H20N2 — CID 64918219

IUPAC1-cyclopropyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine
SMILESCCC(NCc1cccc(C)n1)C1CC1
InChIInChI=1S/C13H20N2/c1-3-13(11-7-8-11)14-9-12-6-4-5-10(2)15-12/h4-6,11,13-14H,3,7-9H2,1-2H3
InChIKeyYHHLAGBZGOPQKA-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.67
Rot. Bonds5

About 1-cyclopropyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine

1-cyclopropyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine (PubChem CID 64918219) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine
PubChem CID64918219
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name1-cyclopropyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine
SMILESCCC(NCc1cccc(C)n1)C1CC1
InChIInChI=1S/C13H20N2/c1-3-13(11-7-8-11)14-9-12-6-4-5-10(2)15-12/h4-6,11,13-14H,3,7-9H2,1-2H3
InChIKeyYHHLAGBZGOPQKA-UHFFFAOYSA-N
XLogP2.67
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine?
The IUPAC name of 1-cyclopropyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine (CID 64918219) is 1-cyclopropyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine.
What is the SMILES notation for 1-cyclopropyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine?
The canonical SMILES for 1-cyclopropyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine is CCC(NCc1cccc(C)n1)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine?
The InChIKey is YHHLAGBZGOPQKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-3-13(11-7-8-11)14-9-12-6-4-5-10(2)15-12/h4-6,11,13-14H,3,7-9H2,1-2H3.
What are the key properties of 1-cyclopropyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine?
1-cyclopropyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine has a molecular weight of 204.32 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine is sourced from PubChem (CID 64918219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).