4-amino-N-cyclopropyl-6-methyl-N-(3-methylbutyl)pyridine-3-carboxamide

C15H23N3O — CID 81239834

IUPAC4-amino-N-cyclopropyl-6-methyl-N-(3-methylbutyl)pyridine-3-carboxamide
SMILESCc1cc(N)c(C(=O)N(CCC(C)C)C2CC2)cn1
InChIInChI=1S/C15H23N3O/c1-10(2)6-7-18(12-4-5-12)15(19)13-9-17-11(3)8-14(13)16/h8-10,12H,4-7H2,1-3H3,(H2,16,17)
InChIKeyJPMFYDDYZMHCEN-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.62
Rot. Bonds5

About 4-amino-N-cyclopropyl-6-methyl-N-(3-methylbutyl)pyridine-3-carboxamide

4-amino-N-cyclopropyl-6-methyl-N-(3-methylbutyl)pyridine-3-carboxamide (PubChem CID 81239834) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 4-amino-N-cyclopropyl-6-methyl-N-(3-methylbutyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-cyclopropyl-6-methyl-N-(3-methylbutyl)pyridine-3-carboxamide
PubChem CID81239834
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name4-amino-N-cyclopropyl-6-methyl-N-(3-methylbutyl)pyridine-3-carboxamide
SMILESCc1cc(N)c(C(=O)N(CCC(C)C)C2CC2)cn1
InChIInChI=1S/C15H23N3O/c1-10(2)6-7-18(12-4-5-12)15(19)13-9-17-11(3)8-14(13)16/h8-10,12H,4-7H2,1-3H3,(H2,16,17)
InChIKeyJPMFYDDYZMHCEN-UHFFFAOYSA-N
XLogP2.62
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclopropyl-6-methyl-N-(3-methylbutyl)pyridine-3-carboxamide?
The IUPAC name of 4-amino-N-cyclopropyl-6-methyl-N-(3-methylbutyl)pyridine-3-carboxamide (CID 81239834) is 4-amino-N-cyclopropyl-6-methyl-N-(3-methylbutyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-amino-N-cyclopropyl-6-methyl-N-(3-methylbutyl)pyridine-3-carboxamide?
The canonical SMILES for 4-amino-N-cyclopropyl-6-methyl-N-(3-methylbutyl)pyridine-3-carboxamide is Cc1cc(N)c(C(=O)N(CCC(C)C)C2CC2)cn1.
What is the InChIKey of 4-amino-N-cyclopropyl-6-methyl-N-(3-methylbutyl)pyridine-3-carboxamide?
The InChIKey is JPMFYDDYZMHCEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-10(2)6-7-18(12-4-5-12)15(19)13-9-17-11(3)8-14(13)16/h8-10,12H,4-7H2,1-3H3,(H2,16,17).
What are the key properties of 4-amino-N-cyclopropyl-6-methyl-N-(3-methylbutyl)pyridine-3-carboxamide?
4-amino-N-cyclopropyl-6-methyl-N-(3-methylbutyl)pyridine-3-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.62, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclopropyl-6-methyl-N-(3-methylbutyl)pyridine-3-carboxamide is sourced from PubChem (CID 81239834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).