N-[2-(tert-butylamino)-2-oxoethyl]-6-(propylamino)pyridine-3-carboxamide

C15H24N4O2 — CID 115357188

IUPACN-[2-(tert-butylamino)-2-oxoethyl]-6-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ccc(C(=O)NCC(=O)NC(C)(C)C)cn1
InChIInChI=1S/C15H24N4O2/c1-5-8-16-12-7-6-11(9-17-12)14(21)18-10-13(20)19-15(2,3)4/h6-7,9H,5,8,10H2,1-4H3,(H,16,17)(H,18,21)(H,19,20)
InChIKeyAGRNNFULQFZAOQ-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.55
Rot. Bonds6

About N-[2-(tert-butylamino)-2-oxoethyl]-6-(propylamino)pyridine-3-carboxamide

N-[2-(tert-butylamino)-2-oxoethyl]-6-(propylamino)pyridine-3-carboxamide (PubChem CID 115357188) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-[2-(tert-butylamino)-2-oxoethyl]-6-(propylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(tert-butylamino)-2-oxoethyl]-6-(propylamino)pyridine-3-carboxamide
PubChem CID115357188
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC NameN-[2-(tert-butylamino)-2-oxoethyl]-6-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ccc(C(=O)NCC(=O)NC(C)(C)C)cn1
InChIInChI=1S/C15H24N4O2/c1-5-8-16-12-7-6-11(9-17-12)14(21)18-10-13(20)19-15(2,3)4/h6-7,9H,5,8,10H2,1-4H3,(H,16,17)(H,18,21)(H,19,20)
InChIKeyAGRNNFULQFZAOQ-UHFFFAOYSA-N
XLogP1.55
TPSA83.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylbutyl)-6-(propylamino)pyridine-3-carboxamide
CID 62693585
N-(2-ethoxyethyl)-6-(propylamino)pyridine-3-carboxamide
CID 62187218
N',N'-dimethyl-6-(propylamino)pyridine-3-carbohydrazide
CID 83024179
N-(cyclobutylmethyl)-6-(propylamino)pyridine-3-carboxamide
CID 62168464
N-[1-oxo-1-(propylamino)propan-2-yl]-6-(propylamino)pyridine-3-carboxamide
CID 62178002
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-6-(propylamino)pyridine-3-carboxamide
CID 62176173
6-(propylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide
CID 62172448
6-(2-phenylethylamino)-N-propylpyridine-3-carboxamide
CID 109151243
N-[(2-fluorophenyl)methyl]-6-(propylamino)pyridine-3-carboxamide
CID 62166042
N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-6-(propylamino)pyridine-3-carboxamide
CID 106408591
4-amino-N-[2-(tert-butylamino)-2-oxoethyl]benzamide
CID 24710255
[6-(propylamino)-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 60722911

Frequently Asked Questions

What is the IUPAC name of N-[2-(tert-butylamino)-2-oxoethyl]-6-(propylamino)pyridine-3-carboxamide?
The IUPAC name of N-[2-(tert-butylamino)-2-oxoethyl]-6-(propylamino)pyridine-3-carboxamide (CID 115357188) is N-[2-(tert-butylamino)-2-oxoethyl]-6-(propylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-[2-(tert-butylamino)-2-oxoethyl]-6-(propylamino)pyridine-3-carboxamide?
The canonical SMILES for N-[2-(tert-butylamino)-2-oxoethyl]-6-(propylamino)pyridine-3-carboxamide is CCCNc1ccc(C(=O)NCC(=O)NC(C)(C)C)cn1.
What is the InChIKey of N-[2-(tert-butylamino)-2-oxoethyl]-6-(propylamino)pyridine-3-carboxamide?
The InChIKey is AGRNNFULQFZAOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-5-8-16-12-7-6-11(9-17-12)14(21)18-10-13(20)19-15(2,3)4/h6-7,9H,5,8,10H2,1-4H3,(H,16,17)(H,18,21)(H,19,20).
What are the key properties of N-[2-(tert-butylamino)-2-oxoethyl]-6-(propylamino)pyridine-3-carboxamide?
N-[2-(tert-butylamino)-2-oxoethyl]-6-(propylamino)pyridine-3-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 1.55, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(tert-butylamino)-2-oxoethyl]-6-(propylamino)pyridine-3-carboxamide is sourced from PubChem (CID 115357188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).