4-(aminomethyl)-6-tert-butyl-N-(cyclopropylmethyl)-N-methylpyridin-2-amine

C15H25N3 — CID 113381367

IUPAC4-(aminomethyl)-6-tert-butyl-N-(cyclopropylmethyl)-N-methylpyridin-2-amine
SMILESCN(CC1CC1)c1cc(CN)cc(C(C)(C)C)n1
InChIInChI=1S/C15H25N3/c1-15(2,3)13-7-12(9-16)8-14(17-13)18(4)10-11-5-6-11/h7-8,11H,5-6,9-10,16H2,1-4H3
InChIKeyMOLVZRDXZJPHJR-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.68
Rot. Bonds4

About 4-(aminomethyl)-6-tert-butyl-N-(cyclopropylmethyl)-N-methylpyridin-2-amine

4-(aminomethyl)-6-tert-butyl-N-(cyclopropylmethyl)-N-methylpyridin-2-amine (PubChem CID 113381367) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 4-(aminomethyl)-6-tert-butyl-N-(cyclopropylmethyl)-N-methylpyridin-2-amine.

Molecular Properties

Compound Name4-(aminomethyl)-6-tert-butyl-N-(cyclopropylmethyl)-N-methylpyridin-2-amine
PubChem CID113381367
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name4-(aminomethyl)-6-tert-butyl-N-(cyclopropylmethyl)-N-methylpyridin-2-amine
SMILESCN(CC1CC1)c1cc(CN)cc(C(C)(C)C)n1
InChIInChI=1S/C15H25N3/c1-15(2,3)13-7-12(9-16)8-14(17-13)18(4)10-11-5-6-11/h7-8,11H,5-6,9-10,16H2,1-4H3
InChIKeyMOLVZRDXZJPHJR-UHFFFAOYSA-N
XLogP2.68
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-6-tert-butyl-N-(cyclopropylmethyl)-N-methylpyridin-2-amine?
The IUPAC name of 4-(aminomethyl)-6-tert-butyl-N-(cyclopropylmethyl)-N-methylpyridin-2-amine (CID 113381367) is 4-(aminomethyl)-6-tert-butyl-N-(cyclopropylmethyl)-N-methylpyridin-2-amine.
What is the SMILES notation for 4-(aminomethyl)-6-tert-butyl-N-(cyclopropylmethyl)-N-methylpyridin-2-amine?
The canonical SMILES for 4-(aminomethyl)-6-tert-butyl-N-(cyclopropylmethyl)-N-methylpyridin-2-amine is CN(CC1CC1)c1cc(CN)cc(C(C)(C)C)n1.
What is the InChIKey of 4-(aminomethyl)-6-tert-butyl-N-(cyclopropylmethyl)-N-methylpyridin-2-amine?
The InChIKey is MOLVZRDXZJPHJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-15(2,3)13-7-12(9-16)8-14(17-13)18(4)10-11-5-6-11/h7-8,11H,5-6,9-10,16H2,1-4H3.
What are the key properties of 4-(aminomethyl)-6-tert-butyl-N-(cyclopropylmethyl)-N-methylpyridin-2-amine?
4-(aminomethyl)-6-tert-butyl-N-(cyclopropylmethyl)-N-methylpyridin-2-amine has a molecular weight of 247.39 g/mol, XLogP of 2.68, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-6-tert-butyl-N-(cyclopropylmethyl)-N-methylpyridin-2-amine is sourced from PubChem (CID 113381367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).