N-[(6-amino-2-methyl-3-pyridinyl)methyl]azetidine-2-carboxamide

C11H16N4O — CID 153286771

IUPACN-[(6-amino-2-methyl-3-pyridinyl)methyl]azetidine-2-carboxamide
SMILESCc1nc(N)ccc1CNC(=O)C1CCN1
InChIInChI=1S/C11H16N4O/c1-7-8(2-3-10(12)15-7)6-14-11(16)9-4-5-13-9/h2-3,9,13H,4-6H2,1H3,(H2,12,15)(H,14,16)
InChIKeyTYQOASBLACQKPH-UHFFFAOYSA-N
MW220.28 g/mol
LogP-0.05
Rot. Bonds3

About N-[(6-amino-2-methyl-3-pyridinyl)methyl]azetidine-2-carboxamide

N-[(6-amino-2-methyl-3-pyridinyl)methyl]azetidine-2-carboxamide (PubChem CID 153286771) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is N-[(6-amino-2-methyl-3-pyridinyl)methyl]azetidine-2-carboxamide.

Molecular Properties

Compound NameN-[(6-amino-2-methyl-3-pyridinyl)methyl]azetidine-2-carboxamide
PubChem CID153286771
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC NameN-[(6-amino-2-methyl-3-pyridinyl)methyl]azetidine-2-carboxamide
SMILESCc1nc(N)ccc1CNC(=O)C1CCN1
InChIInChI=1S/C11H16N4O/c1-7-8(2-3-10(12)15-7)6-14-11(16)9-4-5-13-9/h2-3,9,13H,4-6H2,1H3,(H2,12,15)(H,14,16)
InChIKeyTYQOASBLACQKPH-UHFFFAOYSA-N
XLogP-0.05
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 5-0.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(6-amino-2-methyl-3-pyridinyl)methyl]azetidine-2-carboxamide?
The IUPAC name of N-[(6-amino-2-methyl-3-pyridinyl)methyl]azetidine-2-carboxamide (CID 153286771) is N-[(6-amino-2-methyl-3-pyridinyl)methyl]azetidine-2-carboxamide.
What is the SMILES notation for N-[(6-amino-2-methyl-3-pyridinyl)methyl]azetidine-2-carboxamide?
The canonical SMILES for N-[(6-amino-2-methyl-3-pyridinyl)methyl]azetidine-2-carboxamide is Cc1nc(N)ccc1CNC(=O)C1CCN1.
What is the InChIKey of N-[(6-amino-2-methyl-3-pyridinyl)methyl]azetidine-2-carboxamide?
The InChIKey is TYQOASBLACQKPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-7-8(2-3-10(12)15-7)6-14-11(16)9-4-5-13-9/h2-3,9,13H,4-6H2,1H3,(H2,12,15)(H,14,16).
What are the key properties of N-[(6-amino-2-methyl-3-pyridinyl)methyl]azetidine-2-carboxamide?
N-[(6-amino-2-methyl-3-pyridinyl)methyl]azetidine-2-carboxamide has a molecular weight of 220.28 g/mol, XLogP of -0.05, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-amino-2-methyl-3-pyridinyl)methyl]azetidine-2-carboxamide is sourced from PubChem (CID 153286771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).