N-tert-butyl-4-(2,3-dihydro-1H-indene-2-carbonylamino)pyridine-2-carboxamide

C20H23N3O2 — CID 139347944

IUPACN-tert-butyl-4-(2,3-dihydro-1H-indene-2-carbonylamino)pyridine-2-carboxamide
SMILESCC(C)(C)NC(=O)c1cc(NC(=O)C2Cc3ccccc3C2)ccn1
InChIInChI=1S/C20H23N3O2/c1-20(2,3)23-19(25)17-12-16(8-9-21-17)22-18(24)15-10-13-6-4-5-7-14(13)11-15/h4-9,12,15H,10-11H2,1-3H3,(H,23,25)(H,21,22,24)
InChIKeyJVYKNOUEHRIMRF-UHFFFAOYSA-N
MW337.42 g/mol
LogP2.96
Rot. Bonds3

About N-tert-butyl-4-(2,3-dihydro-1H-indene-2-carbonylamino)pyridine-2-carboxamide

N-tert-butyl-4-(2,3-dihydro-1H-indene-2-carbonylamino)pyridine-2-carboxamide (PubChem CID 139347944) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is N-tert-butyl-4-(2,3-dihydro-1H-indene-2-carbonylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-4-(2,3-dihydro-1H-indene-2-carbonylamino)pyridine-2-carboxamide
PubChem CID139347944
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC NameN-tert-butyl-4-(2,3-dihydro-1H-indene-2-carbonylamino)pyridine-2-carboxamide
SMILESCC(C)(C)NC(=O)c1cc(NC(=O)C2Cc3ccccc3C2)ccn1
InChIInChI=1S/C20H23N3O2/c1-20(2,3)23-19(25)17-12-16(8-9-21-17)22-18(24)15-10-13-6-4-5-7-14(13)11-15/h4-9,12,15H,10-11H2,1-3H3,(H,23,25)(H,21,22,24)
InChIKeyJVYKNOUEHRIMRF-UHFFFAOYSA-N
XLogP2.96
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-tert-butyl-4-hydrazinylpyridine-2-carboxamide
CID 62238108
N-tert-butyl-4-(2-methoxyanilino)pyridine-2-carboxamide
CID 109216878
4-(2-bromoanilino)-N-tert-butylpyridine-2-carboxamide
CID 109216912
N-tert-butyl-4-[[2-(4-hydroxyphenyl)acetyl]amino]pyridine-2-carboxamide
CID 175058901
N-phenyl-2,3-dihydro-1H-indene-2-carboxamide
CID 112520410
N-tert-butyl-4-(2,4,6-trimethylanilino)pyridine-2-carboxamide
CID 109216858
4-(4-acetylanilino)-N-tert-butylpyridine-2-carboxamide
CID 109216893
4-N-(3-acetylphenyl)-2-N-tert-butylpyridine-2,4-dicarboxamide
CID 109089304
N-(3,5-dichloro-4-hydroxyphenyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 106704006
N-(4-bromo-2-pyridinyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 106704334
1-N,4-N-bis[3-(tert-butylcarbamoyl)phenyl]cyclohexane-1,4-dicarboxamide
CID 28639774
N-tert-butyl-4-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetyl]amino]pyridine-2-carboxamide
CID 139348148

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-4-(2,3-dihydro-1H-indene-2-carbonylamino)pyridine-2-carboxamide?
The IUPAC name of N-tert-butyl-4-(2,3-dihydro-1H-indene-2-carbonylamino)pyridine-2-carboxamide (CID 139347944) is N-tert-butyl-4-(2,3-dihydro-1H-indene-2-carbonylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-tert-butyl-4-(2,3-dihydro-1H-indene-2-carbonylamino)pyridine-2-carboxamide?
The canonical SMILES for N-tert-butyl-4-(2,3-dihydro-1H-indene-2-carbonylamino)pyridine-2-carboxamide is CC(C)(C)NC(=O)c1cc(NC(=O)C2Cc3ccccc3C2)ccn1.
What is the InChIKey of N-tert-butyl-4-(2,3-dihydro-1H-indene-2-carbonylamino)pyridine-2-carboxamide?
The InChIKey is JVYKNOUEHRIMRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-20(2,3)23-19(25)17-12-16(8-9-21-17)22-18(24)15-10-13-6-4-5-7-14(13)11-15/h4-9,12,15H,10-11H2,1-3H3,(H,23,25)(H,21,22,24).
What are the key properties of N-tert-butyl-4-(2,3-dihydro-1H-indene-2-carbonylamino)pyridine-2-carboxamide?
N-tert-butyl-4-(2,3-dihydro-1H-indene-2-carbonylamino)pyridine-2-carboxamide has a molecular weight of 337.42 g/mol, XLogP of 2.96, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-4-(2,3-dihydro-1H-indene-2-carbonylamino)pyridine-2-carboxamide is sourced from PubChem (CID 139347944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).