N,2-dimethyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-1,6-naphthyridine-3-carboxamide

C16H17N5O — CID 29025025

IUPACN,2-dimethyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-1,6-naphthyridine-3-carboxamide
SMILESCc1cnc(CN(C)C(=O)c2cc3cnccc3nc2C)[nH]1
InChIInChI=1S/C16H17N5O/c1-10-7-18-15(19-10)9-21(3)16(22)13-6-12-8-17-5-4-14(12)20-11(13)2/h4-8H,9H2,1-3H3,(H,18,19)
InChIKeyHATYBRKWNQANPA-UHFFFAOYSA-N
MW295.35 g/mol
LogP2.24
Rot. Bonds3

About N,2-dimethyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-1,6-naphthyridine-3-carboxamide

N,2-dimethyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-1,6-naphthyridine-3-carboxamide (PubChem CID 29025025) has the molecular formula C16H17N5O and a molecular weight of 295.35 g/mol. Its IUPAC name is N,2-dimethyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-1,6-naphthyridine-3-carboxamide.

Molecular Properties

Compound NameN,2-dimethyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-1,6-naphthyridine-3-carboxamide
PubChem CID29025025
Molecular FormulaC16H17N5O
Molecular Weight295.35 g/mol
Exact Mass295.14
IUPAC NameN,2-dimethyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-1,6-naphthyridine-3-carboxamide
SMILESCc1cnc(CN(C)C(=O)c2cc3cnccc3nc2C)[nH]1
InChIInChI=1S/C16H17N5O/c1-10-7-18-15(19-10)9-21(3)16(22)13-6-12-8-17-5-4-14(12)20-11(13)2/h4-8H,9H2,1-3H3,(H,18,19)
InChIKeyHATYBRKWNQANPA-UHFFFAOYSA-N
XLogP2.24
TPSA74.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-1,6-naphthyridine-3-carboxamide?
The IUPAC name of N,2-dimethyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-1,6-naphthyridine-3-carboxamide (CID 29025025) is N,2-dimethyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-1,6-naphthyridine-3-carboxamide.
What is the SMILES notation for N,2-dimethyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-1,6-naphthyridine-3-carboxamide?
The canonical SMILES for N,2-dimethyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-1,6-naphthyridine-3-carboxamide is Cc1cnc(CN(C)C(=O)c2cc3cnccc3nc2C)[nH]1.
What is the InChIKey of N,2-dimethyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-1,6-naphthyridine-3-carboxamide?
The InChIKey is HATYBRKWNQANPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O/c1-10-7-18-15(19-10)9-21(3)16(22)13-6-12-8-17-5-4-14(12)20-11(13)2/h4-8H,9H2,1-3H3,(H,18,19).
What are the key properties of N,2-dimethyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-1,6-naphthyridine-3-carboxamide?
N,2-dimethyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-1,6-naphthyridine-3-carboxamide has a molecular weight of 295.35 g/mol, XLogP of 2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-[(5-methyl-1H-imidazol-2-yl)methyl]-1,6-naphthyridine-3-carboxamide is sourced from PubChem (CID 29025025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).