N-cyclopropyl-3-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)pyridin-2-amine

C15H23N3O — CID 62295318

IUPACN-cyclopropyl-3-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)pyridin-2-amine
SMILESCOCCN(c1ncccc1CNC1CC1)C1CC1
InChIInChI=1S/C15H23N3O/c1-19-10-9-18(14-6-7-14)15-12(3-2-8-16-15)11-17-13-4-5-13/h2-3,8,13-14,17H,4-7,9-11H2,1H3
InChIKeyLTWZPZHSGQYOPC-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.95
Rot. Bonds8

About N-cyclopropyl-3-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)pyridin-2-amine

N-cyclopropyl-3-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)pyridin-2-amine (PubChem CID 62295318) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-cyclopropyl-3-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-3-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)pyridin-2-amine
PubChem CID62295318
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-cyclopropyl-3-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)pyridin-2-amine
SMILESCOCCN(c1ncccc1CNC1CC1)C1CC1
InChIInChI=1S/C15H23N3O/c1-19-10-9-18(14-6-7-14)15-12(3-2-8-16-15)11-17-13-4-5-13/h2-3,8,13-14,17H,4-7,9-11H2,1H3
InChIKeyLTWZPZHSGQYOPC-UHFFFAOYSA-N
XLogP1.95
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)pyridin-2-amine?
The IUPAC name of N-cyclopropyl-3-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)pyridin-2-amine (CID 62295318) is N-cyclopropyl-3-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)pyridin-2-amine.
What is the SMILES notation for N-cyclopropyl-3-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)pyridin-2-amine?
The canonical SMILES for N-cyclopropyl-3-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)pyridin-2-amine is COCCN(c1ncccc1CNC1CC1)C1CC1.
What is the InChIKey of N-cyclopropyl-3-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)pyridin-2-amine?
The InChIKey is LTWZPZHSGQYOPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-19-10-9-18(14-6-7-14)15-12(3-2-8-16-15)11-17-13-4-5-13/h2-3,8,13-14,17H,4-7,9-11H2,1H3.
What are the key properties of N-cyclopropyl-3-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)pyridin-2-amine?
N-cyclopropyl-3-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)pyridin-2-amine has a molecular weight of 261.37 g/mol, XLogP of 1.95, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)pyridin-2-amine is sourced from PubChem (CID 62295318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).