N-(1-nitroso-2,3-dihydro-1H-inden-5-yl)-2-thiophen-2-ylimidazo[1,2-a]pyrazin-3-amine

C19H15N5OS — CID 90829131

IUPACN-(1-nitroso-2,3-dihydro-1H-inden-5-yl)-2-thiophen-2-ylimidazo[1,2-a]pyrazin-3-amine
SMILESO=NC1CCc2cc(Nc3c(-c4cccs4)nc4cnccn34)ccc21
InChIInChI=1S/C19H15N5OS/c25-23-15-6-3-12-10-13(4-5-14(12)15)21-19-18(16-2-1-9-26-16)22-17-11-20-7-8-24(17)19/h1-2,4-5,7-11,15,21H,3,6H2
InChIKeyUFSMTEDMADNSJE-UHFFFAOYSA-N
MW361.43 g/mol
LogP4.96
Rot. Bonds4

About N-(1-nitroso-2,3-dihydro-1H-inden-5-yl)-2-thiophen-2-ylimidazo[1,2-a]pyrazin-3-amine

N-(1-nitroso-2,3-dihydro-1H-inden-5-yl)-2-thiophen-2-ylimidazo[1,2-a]pyrazin-3-amine (PubChem CID 90829131) has the molecular formula C19H15N5OS and a molecular weight of 361.43 g/mol. Its IUPAC name is N-(1-nitroso-2,3-dihydro-1H-inden-5-yl)-2-thiophen-2-ylimidazo[1,2-a]pyrazin-3-amine.

Molecular Properties

Compound NameN-(1-nitroso-2,3-dihydro-1H-inden-5-yl)-2-thiophen-2-ylimidazo[1,2-a]pyrazin-3-amine
PubChem CID90829131
Molecular FormulaC19H15N5OS
Molecular Weight361.43 g/mol
Exact Mass361.10
IUPAC NameN-(1-nitroso-2,3-dihydro-1H-inden-5-yl)-2-thiophen-2-ylimidazo[1,2-a]pyrazin-3-amine
SMILESO=NC1CCc2cc(Nc3c(-c4cccs4)nc4cnccn34)ccc21
InChIInChI=1S/C19H15N5OS/c25-23-15-6-3-12-10-13(4-5-14(12)15)21-19-18(16-2-1-9-26-16)22-17-11-20-7-8-24(17)19/h1-2,4-5,7-11,15,21H,3,6H2
InChIKeyUFSMTEDMADNSJE-UHFFFAOYSA-N
XLogP4.96
TPSA71.65 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.43
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-(4-methoxynaphthalen-1-yl)-N-(1-nitroso-2,3-dihydro-1H-inden-5-yl)imidazo[1,2-a]pyrazin-3-amine
CID 90889782
2-(4-aminophenyl)-N-(2,3-dihydro-1H-inden-5-yl)imidazo[1,2-a]pyrazin-3-amine
CID 141165893
N-(furan-2-ylmethyl)-2-thiophen-2-ylimidazo[1,2-a]pyrazin-3-amine
CID 95802609
N-[4-[3-[(1-hydroxyimino-2,3-dihydroinden-5-yl)amino]imidazo[1,2-a]pyrazin-2-yl]phenyl]acetamide
CID 157197195
N-[3-[3-[[(1E)-1-hydroxyimino-2,3-dihydroinden-5-yl]amino]imidazo[1,2-a]pyrazin-2-yl]-4-methylphenyl]acetamide
CID 135510543
3-[(2-phenylimidazo[1,2-a]pyrazin-3-yl)amino]benzoic acid
CID 53207883
3-[(2-phenylimidazo[1,2-a]pyrazin-3-yl)amino]benzamide
CID 53207762
4-[3-[[(1Z)-1-hydroxyimino-2,3-dihydroinden-5-yl]amino]imidazo[1,2-a]pyrazin-2-yl]benzonitrile
CID 135510576
(NE)-N-[5-[(2-methylimidazo[1,2-a]pyrazin-3-yl)amino]-2,3-dihydroinden-1-ylidene]hydroxylamine
CID 135510620
3-[(1-nitroso-2,3-dihydro-1H-inden-5-yl)amino]-N-(pyrimidin-2-ylmethyl)furo[2,3-c]pyridine-2-carboxamide
CID 91137476
2-(4-aminophenyl)-N-(3-chlorophenyl)imidazo[1,2-a]pyrazin-3-amine;but-2-yne;ethane
CID 143150792
tert-butyl N-[5-[3-[[(1E)-1-hydroxyimino-2,3-dihydroinden-5-yl]amino]imidazo[1,2-a]pyrazin-2-yl]-2-pyridinyl]carbamate
CID 135510587

Frequently Asked Questions

What is the IUPAC name of N-(1-nitroso-2,3-dihydro-1H-inden-5-yl)-2-thiophen-2-ylimidazo[1,2-a]pyrazin-3-amine?
The IUPAC name of N-(1-nitroso-2,3-dihydro-1H-inden-5-yl)-2-thiophen-2-ylimidazo[1,2-a]pyrazin-3-amine (CID 90829131) is N-(1-nitroso-2,3-dihydro-1H-inden-5-yl)-2-thiophen-2-ylimidazo[1,2-a]pyrazin-3-amine.
What is the SMILES notation for N-(1-nitroso-2,3-dihydro-1H-inden-5-yl)-2-thiophen-2-ylimidazo[1,2-a]pyrazin-3-amine?
The canonical SMILES for N-(1-nitroso-2,3-dihydro-1H-inden-5-yl)-2-thiophen-2-ylimidazo[1,2-a]pyrazin-3-amine is O=NC1CCc2cc(Nc3c(-c4cccs4)nc4cnccn34)ccc21.
What is the InChIKey of N-(1-nitroso-2,3-dihydro-1H-inden-5-yl)-2-thiophen-2-ylimidazo[1,2-a]pyrazin-3-amine?
The InChIKey is UFSMTEDMADNSJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5OS/c25-23-15-6-3-12-10-13(4-5-14(12)15)21-19-18(16-2-1-9-26-16)22-17-11-20-7-8-24(17)19/h1-2,4-5,7-11,15,21H,3,6H2.
What are the key properties of N-(1-nitroso-2,3-dihydro-1H-inden-5-yl)-2-thiophen-2-ylimidazo[1,2-a]pyrazin-3-amine?
N-(1-nitroso-2,3-dihydro-1H-inden-5-yl)-2-thiophen-2-ylimidazo[1,2-a]pyrazin-3-amine has a molecular weight of 361.43 g/mol, XLogP of 4.96, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-nitroso-2,3-dihydro-1H-inden-5-yl)-2-thiophen-2-ylimidazo[1,2-a]pyrazin-3-amine is sourced from PubChem (CID 90829131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).