N-ethyl-4-[(2-methylpyrimidin-4-yl)methylamino]pyridine-2-carboxamide

C14H17N5O — CID 61016724

IUPACN-ethyl-4-[(2-methylpyrimidin-4-yl)methylamino]pyridine-2-carboxamide
SMILESCCNC(=O)c1cc(NCc2ccnc(C)n2)ccn1
InChIInChI=1S/C14H17N5O/c1-3-15-14(20)13-8-11(4-7-17-13)18-9-12-5-6-16-10(2)19-12/h4-8H,3,9H2,1-2H3,(H,15,20)(H,17,18)
InChIKeyNUQMJPDORSSVHP-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.54
Rot. Bonds5

About N-ethyl-4-[(2-methylpyrimidin-4-yl)methylamino]pyridine-2-carboxamide

N-ethyl-4-[(2-methylpyrimidin-4-yl)methylamino]pyridine-2-carboxamide (PubChem CID 61016724) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is N-ethyl-4-[(2-methylpyrimidin-4-yl)methylamino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-[(2-methylpyrimidin-4-yl)methylamino]pyridine-2-carboxamide
PubChem CID61016724
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC NameN-ethyl-4-[(2-methylpyrimidin-4-yl)methylamino]pyridine-2-carboxamide
SMILESCCNC(=O)c1cc(NCc2ccnc(C)n2)ccn1
InChIInChI=1S/C14H17N5O/c1-3-15-14(20)13-8-11(4-7-17-13)18-9-12-5-6-16-10(2)19-12/h4-8H,3,9H2,1-2H3,(H,15,20)(H,17,18)
InChIKeyNUQMJPDORSSVHP-UHFFFAOYSA-N
XLogP1.54
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(methylamino)-N-[(2-methylpyrimidin-4-yl)methyl]pyridine-2-carboxamide
CID 55046845
N-ethyl-4-[(5-methylfuran-2-yl)methylamino]pyridine-2-carboxamide
CID 55081264
4-[(2-amino-2-oxoethyl)amino]-N-ethylpyridine-2-carboxamide
CID 43517858
4-[(2-bromophenyl)methylamino]-N-ethylpyridine-2-carboxamide
CID 61401901
N-ethyl-4-(1H-1,2,4-triazol-5-ylmethylamino)pyridine-2-carboxamide
CID 54884795
4-[(2-chlorophenyl)methylamino]-N-ethylpyridine-2-carboxamide
CID 43517871
N-ethyl-4-(prop-2-enylamino)pyridine-2-carboxamide
CID 62142219
N-ethyl-4-[2-(propylamino)ethylamino]pyridine-2-carboxamide
CID 55101029
N-ethyl-4-[(2,2,3,3-tetramethylcyclopropyl)methylamino]pyridine-2-carboxamide
CID 79358278
4-[(4-amino-2,2-dimethylbutyl)amino]-N-ethylpyridine-2-carboxamide
CID 106142444
4-(ethylamino)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-2-carboxamide
CID 62180134
N-benzyl-4-(ethylamino)pyridine-2-carboxamide
CID 55042680

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[(2-methylpyrimidin-4-yl)methylamino]pyridine-2-carboxamide?
The IUPAC name of N-ethyl-4-[(2-methylpyrimidin-4-yl)methylamino]pyridine-2-carboxamide (CID 61016724) is N-ethyl-4-[(2-methylpyrimidin-4-yl)methylamino]pyridine-2-carboxamide.
What is the SMILES notation for N-ethyl-4-[(2-methylpyrimidin-4-yl)methylamino]pyridine-2-carboxamide?
The canonical SMILES for N-ethyl-4-[(2-methylpyrimidin-4-yl)methylamino]pyridine-2-carboxamide is CCNC(=O)c1cc(NCc2ccnc(C)n2)ccn1.
What is the InChIKey of N-ethyl-4-[(2-methylpyrimidin-4-yl)methylamino]pyridine-2-carboxamide?
The InChIKey is NUQMJPDORSSVHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c1-3-15-14(20)13-8-11(4-7-17-13)18-9-12-5-6-16-10(2)19-12/h4-8H,3,9H2,1-2H3,(H,15,20)(H,17,18).
What are the key properties of N-ethyl-4-[(2-methylpyrimidin-4-yl)methylamino]pyridine-2-carboxamide?
N-ethyl-4-[(2-methylpyrimidin-4-yl)methylamino]pyridine-2-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 1.54, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[(2-methylpyrimidin-4-yl)methylamino]pyridine-2-carboxamide is sourced from PubChem (CID 61016724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).