N-(5-amino-2-pyridinyl)-N-propan-2-ylheptanamide

C15H25N3O — CID 115273944

IUPACN-(5-amino-2-pyridinyl)-N-propan-2-ylheptanamide
SMILESCCCCCCC(=O)N(c1ccc(N)cn1)C(C)C
InChIInChI=1S/C15H25N3O/c1-4-5-6-7-8-15(19)18(12(2)3)14-10-9-13(16)11-17-14/h9-12H,4-8,16H2,1-3H3
InChIKeySAXIGHIZBLJNAP-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.38
Rot. Bonds7

About N-(5-amino-2-pyridinyl)-N-propan-2-ylheptanamide

N-(5-amino-2-pyridinyl)-N-propan-2-ylheptanamide (PubChem CID 115273944) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-(5-amino-2-pyridinyl)-N-propan-2-ylheptanamide.

Molecular Properties

Compound NameN-(5-amino-2-pyridinyl)-N-propan-2-ylheptanamide
PubChem CID115273944
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-(5-amino-2-pyridinyl)-N-propan-2-ylheptanamide
SMILESCCCCCCC(=O)N(c1ccc(N)cn1)C(C)C
InChIInChI=1S/C15H25N3O/c1-4-5-6-7-8-15(19)18(12(2)3)14-10-9-13(16)11-17-14/h9-12H,4-8,16H2,1-3H3
InChIKeySAXIGHIZBLJNAP-UHFFFAOYSA-N
XLogP3.38
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-pyridinyl)-N-propan-2-ylheptanamide?
The IUPAC name of N-(5-amino-2-pyridinyl)-N-propan-2-ylheptanamide (CID 115273944) is N-(5-amino-2-pyridinyl)-N-propan-2-ylheptanamide.
What is the SMILES notation for N-(5-amino-2-pyridinyl)-N-propan-2-ylheptanamide?
The canonical SMILES for N-(5-amino-2-pyridinyl)-N-propan-2-ylheptanamide is CCCCCCC(=O)N(c1ccc(N)cn1)C(C)C.
What is the InChIKey of N-(5-amino-2-pyridinyl)-N-propan-2-ylheptanamide?
The InChIKey is SAXIGHIZBLJNAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-4-5-6-7-8-15(19)18(12(2)3)14-10-9-13(16)11-17-14/h9-12H,4-8,16H2,1-3H3.
What are the key properties of N-(5-amino-2-pyridinyl)-N-propan-2-ylheptanamide?
N-(5-amino-2-pyridinyl)-N-propan-2-ylheptanamide has a molecular weight of 263.38 g/mol, XLogP of 3.38, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-pyridinyl)-N-propan-2-ylheptanamide is sourced from PubChem (CID 115273944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).